1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene

C333H427F5O4 — CID 159244025

IUPAC1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.CC1CCC(c2ccc(C#Cc3ccc(F)c(F)c3)cc2)CC1.CC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCC1CCC(c2ccc(C#Cc3ccc(OC)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(C)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(OCC)cc3)cc2)CC1.CCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCc1ccc(C#Cc2ccc(C3CCC(CCC)CC3)cc2)cc1.CCCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1
InChIInChI=1S/C28H35F.C28H36.C26H31F.C26H32.2C25H30O.C25H30.C24H28O.2C24H28.C23H26O.C21H20F2.C21H21F.13CH4/c1-2-3-4-5-6-7-8-23-11-17-26(18-12-23)27-19-13-24(14-20-27)9-10-25-15-21-28(29)22-16-25;1-3-5-6-8-24-9-11-25(12-10-24)13-14-26-17-21-28(22-18-26)27-19-15-23(7-4-2)16-20-27;1-2-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(27)20-14-23;1-3-5-6-22-7-9-23(10-8-22)11-12-24-15-19-26(20-16-24)25-17-13-21(4-2)14-18-25;1-3-19-26-25-17-11-22(12-18-25)6-5-21-9-15-24(16-10-21)23-13-7-20(4-2)8-14-23;1-3-5-20-8-14-23(15-9-20)24-16-10-21(11-17-24)6-7-22-12-18-25(19-13-22)26-4-2;1-3-5-21-6-8-22(9-7-21)10-11-23-14-18-25(19-15-23)24-16-12-20(4-2)13-17-24;1-3-19-7-13-22(14-8-19)23-15-9-20(10-16-23)5-6-21-11-17-24(18-12-21)25-4-2;1-3-4-20-11-15-23(16-12-20)24-17-13-22(14-18-24)10-9-21-7-5-19(2)6-8-21;1-3-19-5-7-21(8-6-19)9-10-22-13-17-24(18-14-22)23-15-11-20(4-2)12-16-23;1-3-18-6-12-21(13-7-18)22-14-8-19(9-15-22)4-5-20-10-16-23(24-2)17-11-20;1-15-2-9-18(10-3-15)19-11-6-16(7-12-19)4-5-17-8-13-20(22)21(23)14-17;1-16-2-10-19(11-3-16)20-12-6-17(7-13-20)4-5-18-8-14-21(22)15-9-18;;;;;;;;;;;;;/h13-16,19-23,26H,2-8,11-12,17-18H2,1H3;9-12,17-18,21-23,27H,3-8,15-16,19-20H2,1-2H3;11-14,17-21,24H,2-6,9-10,15-16H2,1H3;7-10,15-16,19-21,25H,3-6,13-14,17-18H2,1-2H3;9-12,15-18,20,23H,3-4,7-8,13-14,19H2,1-2H3;10-13,16-20,23H,3-5,8-9,14-15H2,1-2H3;6-9,14-15,18-20,24H,3-5,12-13,16-17H2,1-2H3;9-12,15-19,22H,3-4,7-8,13-14H2,1-2H3;2*5-8,13-14,17-18,20,23H,3-4,11-12,15-16H2,1-2H3;8-11,14-18,21H,3,6-7,12-13H2,1-2H3;6-8,11-15,18H,2-3,9-10H2,1H3;6-9,12-16,19H,2-3,10-11H2,1H3;13*1H4
InChIKeyKULJBVCECZWMRU-UHFFFAOYSA-N
MW4589.06 g/mol
LogP94.76
Rot. Bonds55

About 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene

1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene (PubChem CID 159244025) has the molecular formula C333H427F5O4 and a molecular weight of 4589.06 g/mol. Its IUPAC name is 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene.

Molecular Properties

Compound Name1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene
PubChem CID159244025
Molecular FormulaC333H427F5O4
Molecular Weight4589.06 g/mol
Exact Mass4585.31
IUPAC Name1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.CC1CCC(c2ccc(C#Cc3ccc(F)c(F)c3)cc2)CC1.CC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCC1CCC(c2ccc(C#Cc3ccc(OC)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(C)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(OCC)cc3)cc2)CC1.CCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCc1ccc(C#Cc2ccc(C3CCC(CCC)CC3)cc2)cc1.CCCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1
InChIInChI=1S/C28H35F.C28H36.C26H31F.C26H32.2C25H30O.C25H30.C24H28O.2C24H28.C23H26O.C21H20F2.C21H21F.13CH4/c1-2-3-4-5-6-7-8-23-11-17-26(18-12-23)27-19-13-24(14-20-27)9-10-25-15-21-28(29)22-16-25;1-3-5-6-8-24-9-11-25(12-10-24)13-14-26-17-21-28(22-18-26)27-19-15-23(7-4-2)16-20-27;1-2-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(27)20-14-23;1-3-5-6-22-7-9-23(10-8-22)11-12-24-15-19-26(20-16-24)25-17-13-21(4-2)14-18-25;1-3-19-26-25-17-11-22(12-18-25)6-5-21-9-15-24(16-10-21)23-13-7-20(4-2)8-14-23;1-3-5-20-8-14-23(15-9-20)24-16-10-21(11-17-24)6-7-22-12-18-25(19-13-22)26-4-2;1-3-5-21-6-8-22(9-7-21)10-11-23-14-18-25(19-15-23)24-16-12-20(4-2)13-17-24;1-3-19-7-13-22(14-8-19)23-15-9-20(10-16-23)5-6-21-11-17-24(18-12-21)25-4-2;1-3-4-20-11-15-23(16-12-20)24-17-13-22(14-18-24)10-9-21-7-5-19(2)6-8-21;1-3-19-5-7-21(8-6-19)9-10-22-13-17-24(18-14-22)23-15-11-20(4-2)12-16-23;1-3-18-6-12-21(13-7-18)22-14-8-19(9-15-22)4-5-20-10-16-23(24-2)17-11-20;1-15-2-9-18(10-3-15)19-11-6-16(7-12-19)4-5-17-8-13-20(22)21(23)14-17;1-16-2-10-19(11-3-16)20-12-6-17(7-13-20)4-5-18-8-14-21(22)15-9-18;;;;;;;;;;;;;/h13-16,19-23,26H,2-8,11-12,17-18H2,1H3;9-12,17-18,21-23,27H,3-8,15-16,19-20H2,1-2H3;11-14,17-21,24H,2-6,9-10,15-16H2,1H3;7-10,15-16,19-21,25H,3-6,13-14,17-18H2,1-2H3;9-12,15-18,20,23H,3-4,7-8,13-14,19H2,1-2H3;10-13,16-20,23H,3-5,8-9,14-15H2,1-2H3;6-9,14-15,18-20,24H,3-5,12-13,16-17H2,1-2H3;9-12,15-19,22H,3-4,7-8,13-14H2,1-2H3;2*5-8,13-14,17-18,20,23H,3-4,11-12,15-16H2,1-2H3;8-11,14-18,21H,3,6-7,12-13H2,1-2H3;6-8,11-15,18H,2-3,9-10H2,1H3;6-9,12-16,19H,2-3,10-11H2,1H3;13*1H4
InChIKeyKULJBVCECZWMRU-UHFFFAOYSA-N
XLogP94.76
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds55
Heavy Atoms342
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004589.06
LogP ≤ 594.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene with MolForge

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Related Compounds

1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene;(4-butylphenyl) 4-[2-(4-butylphenyl)ethynyl]benzoate;1,2-difluoro-4-[2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]ethynyl]benzene;(4-ethylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate;1-(4-hexylcyclohexyl)-4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]benzene;1-methyl-4-[2-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]ethynyl]benzene;bis(1-pentyl-4-[2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]ethynyl]benzene);(4-pentylphenyl) 4-[2-(4-hexylphenyl)ethynyl]benzoate;(4-pentylphenyl) 4-[2-(4-pentylphenyl)ethynyl]benzoate;1-pentyl-4-[2-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]ethynyl]benzene;(4-propylphenyl) 4-[2-(4-pentylphenyl)ethynyl]benzoate;(4-propylphenyl) 4-[2-(4-propylphenyl)ethynyl]benzoate
CID 161382018
1-(4-butylcyclohexyl)-4-[2-(4-methylphenyl)ethynyl]benzene;1-butyl-4-[2-(4-ethoxyphenyl)ethynyl]benzene;(4-cyano-3-fluorophenyl) 4-ethylbenzoate;(4-cyano-3-fluorophenyl) 4-propylbenzoate;(4-cyanophenyl) 4-butylbenzoate;(4-cyanophenyl) 4-ethylbenzoate;1-ethoxy-4-(4-propylcyclohexyl)benzene;1-ethoxy-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-methoxy-4-[2-(4-pentylphenyl)ethynyl]benzene;4-(4-propylcyclohexyl)benzonitrile
CID 158678754
1-butoxy-4-[2-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]ethynyl]benzene;1-methoxy-4-[2-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]ethynyl]benzene;1-[2-(4-methylcyclohexyl)ethyl]-4-[2-(4-pentoxyphenyl)ethynyl]benzene;1-[2-(4-methylcyclohexyl)ethyl]-4-[2-(4-propoxyphenyl)ethynyl]benzene
CID 173394271
1-but-3-enyl-4-(4-methylphenyl)benzene;1-(4-but-3-enylphenyl)-4-(4-ethylphenyl)-2-fluorobenzene;4-(4-but-3-enylphenyl)-1-(4-ethylphenyl)-2-fluorobenzene;4-(4-but-3-enylphenyl)-2-fluoro-1-(4-methylphenyl)benzene;1-ethoxy-4-(4-pentylcyclohexyl)benzene;2-fluoro-4-propyl-1-(4-propylcyclohexyl)benzene;1-methoxy-4-(4-propylcyclohexyl)benzene;1-methyl-4-(4-pentylphenyl)benzene
CID 157215334
1-butyl-4-(4-propylcyclohexyl)benzene;1-ethoxy-4-(4-propylcyclohexyl)benzene;1-methyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 159548432
1,2-difluoro-4-[2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]ethynyl]benzene
CID 22089477
2-ethoxy-6-[2-[4-(4-heptylcyclohexyl)phenyl]ethynyl]naphthalene
CID 19912583
2-octyl-6-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]naphthalene
CID 19912488
2-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]-6-propylnaphthalene
CID 19912291
2-heptyl-6-[2-[4-(4-pentylcyclohexyl)phenyl]ethynyl]naphthalene
CID 19912316
4-[2-[4-(4-butoxyphenyl)phenyl]ethyl]-2-fluorobenzonitrile;4-[2-[4-(4-butylphenyl)phenyl]ethyl]-2-fluorobenzonitrile;4-[2-[4-(4-ethoxyphenyl)phenyl]ethyl]-2-fluorobenzonitrile;4-[2-[4-(4-ethylphenyl)phenyl]ethyl]-2-fluorobenzonitrile;2-fluoro-4-[2-[4-(4-heptylphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-hexylphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-methoxyphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-methylphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-pentoxyphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-pentylphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-propoxyphenyl)phenyl]ethyl]benzonitrile;2-fluoro-4-[2-[4-(4-propylphenyl)phenyl]ethyl]benzonitrile
CID 173419792
1-butyl-4-[2-[4-(4-pentylcyclohexyl)phenyl]ethynyl]benzene
CID 23391100

Frequently Asked Questions

What is the IUPAC name of 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene?
The IUPAC name of 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene (CID 159244025) is 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene.
What is the SMILES notation for 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene?
The canonical SMILES for 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene is C.C.C.C.C.C.C.C.C.C.C.C.C.CC1CCC(c2ccc(C#Cc3ccc(F)c(F)c3)cc2)CC1.CC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCC1CCC(c2ccc(C#Cc3ccc(OC)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(C)cc3)cc2)CC1.CCCC1CCC(c2ccc(C#Cc3ccc(OCC)cc3)cc2)CC1.CCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCCCCC1CCC(c2ccc(C#Cc3ccc(F)cc3)cc2)CC1.CCCCCc1ccc(C#Cc2ccc(C3CCC(CCC)CC3)cc2)cc1.CCCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCOc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.CCc1ccc(C#Cc2ccc(C3CCC(CC)CC3)cc2)cc1.
What is the InChIKey of 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene?
The InChIKey is KULJBVCECZWMRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35F.C28H36.C26H31F.C26H32.2C25H30O.C25H30.C24H28O.2C24H28.C23H26O.C21H20F2.C21H21F.13CH4/c1-2-3-4-5-6-7-8-23-11-17-26(18-12-23)27-19-13-24(14-20-27)9-10-25-15-21-28(29)22-16-25;1-3-5-6-8-24-9-11-25(12-10-24)13-14-26-17-21-28(22-18-26)27-19-15-23(7-4-2)16-20-27;1-2-3-4-5-6-21-9-15-24(16-10-21)25-17-11-22(12-18-25)7-8-23-13-19-26(27)20-14-23;1-3-5-6-22-7-9-23(10-8-22)11-12-24-15-19-26(20-16-24)25-17-13-21(4-2)14-18-25;1-3-19-26-25-17-11-22(12-18-25)6-5-21-9-15-24(16-10-21)23-13-7-20(4-2)8-14-23;1-3-5-20-8-14-23(15-9-20)24-16-10-21(11-17-24)6-7-22-12-18-25(19-13-22)26-4-2;1-3-5-21-6-8-22(9-7-21)10-11-23-14-18-25(19-15-23)24-16-12-20(4-2)13-17-24;1-3-19-7-13-22(14-8-19)23-15-9-20(10-16-23)5-6-21-11-17-24(18-12-21)25-4-2;1-3-4-20-11-15-23(16-12-20)24-17-13-22(14-18-24)10-9-21-7-5-19(2)6-8-21;1-3-19-5-7-21(8-6-19)9-10-22-13-17-24(18-14-22)23-15-11-20(4-2)12-16-23;1-3-18-6-12-21(13-7-18)22-14-8-19(9-15-22)4-5-20-10-16-23(24-2)17-11-20;1-15-2-9-18(10-3-15)19-11-6-16(7-12-19)4-5-17-8-13-20(22)21(23)14-17;1-16-2-10-19(11-3-16)20-12-6-17(7-13-20)4-5-18-8-14-21(22)15-9-18;;;;;;;;;;;;;/h13-16,19-23,26H,2-8,11-12,17-18H2,1H3;9-12,17-18,21-23,27H,3-8,15-16,19-20H2,1-2H3;11-14,17-21,24H,2-6,9-10,15-16H2,1H3;7-10,15-16,19-21,25H,3-6,13-14,17-18H2,1-2H3;9-12,15-18,20,23H,3-4,7-8,13-14,19H2,1-2H3;10-13,16-20,23H,3-5,8-9,14-15H2,1-2H3;6-9,14-15,18-20,24H,3-5,12-13,16-17H2,1-2H3;9-12,15-19,22H,3-4,7-8,13-14H2,1-2H3;2*5-8,13-14,17-18,20,23H,3-4,11-12,15-16H2,1-2H3;8-11,14-18,21H,3,6-7,12-13H2,1-2H3;6-8,11-15,18H,2-3,9-10H2,1H3;6-9,12-16,19H,2-3,10-11H2,1H3;13*1H4.
What are the key properties of 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene?
1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene has a molecular weight of 4589.06 g/mol, XLogP of 94.76, 55 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1,2-difluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-ethoxy-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-methoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene;1-(4-ethylcyclohexyl)-4-[2-(4-propylphenyl)ethynyl]benzene;1-ethyl-4-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-hexylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;1-fluoro-4-[2-[4-(4-octylcyclohexyl)phenyl]ethynyl]benzene;methane;1-methyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene;1-pentyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]benzene is sourced from PubChem (CID 159244025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).