1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene

C92H112F8O2 — CID 158062229

IUPAC1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene
SMILESCCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCOc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)c(F)c1F
InChIInChI=1S/C24H30F2.C23H28F2O.C23H28F2.C22H26F2O/c1-3-5-6-18-9-13-20(14-10-18)22-16-15-21(23(25)24(22)26)19-11-7-17(4-2)8-12-19;1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24;1-3-5-17-8-12-19(13-9-17)21-15-14-20(22(24)23(21)25)18-10-6-16(4-2)7-11-18;1-3-15-5-7-16(8-6-15)17-9-11-18(12-10-17)19-13-14-20(25-4-2)22(24)21(19)23/h7-8,11-12,15-16,18,20H,3-6,9-10,13-14H2,1-2H3;10-17H,3-9H2,1-2H3;6-7,10-11,14-15,17,19H,3-5,8-9,12-13H2,1-2H3;9-16H,3-8H2,1-2H3
InChIKeyFKUDDHFDEPLCJZ-UHFFFAOYSA-N
MW1401.89 g/mol
LogP28.75
Rot. Bonds22

About 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene

1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene (PubChem CID 158062229) has the molecular formula C92H112F8O2 and a molecular weight of 1401.89 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene
PubChem CID158062229
Molecular FormulaC92H112F8O2
Molecular Weight1401.89 g/mol
Exact Mass1400.85
IUPAC Name1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene
SMILESCCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCOc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)c(F)c1F
InChIInChI=1S/C24H30F2.C23H28F2O.C23H28F2.C22H26F2O/c1-3-5-6-18-9-13-20(14-10-18)22-16-15-21(23(25)24(22)26)19-11-7-17(4-2)8-12-19;1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24;1-3-5-17-8-12-19(13-9-17)21-15-14-20(22(24)23(21)25)18-10-6-16(4-2)7-11-18;1-3-15-5-7-16(8-6-15)17-9-11-18(12-10-17)19-13-14-20(25-4-2)22(24)21(19)23/h7-8,11-12,15-16,18,20H,3-6,9-10,13-14H2,1-2H3;10-17H,3-9H2,1-2H3;6-7,10-11,14-15,17,19H,3-5,8-9,12-13H2,1-2H3;9-16H,3-8H2,1-2H3
InChIKeyFKUDDHFDEPLCJZ-UHFFFAOYSA-N
XLogP28.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds22
Heavy Atoms102
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001401.89
LogP ≤ 528.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene with MolForge

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Related Compounds

1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-2,3-difluoro-4-(4-propylphenyl)benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-ethyl-4-(4-propylcyclohexyl)cyclohexane;1-ethyl-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-methoxy-4-(4-propylcyclohexyl)benzene;1-pentyl-4-(4-propylcyclohexyl)cyclohexane;1-[(E)-prop-1-enyl]-4-(4-propylcyclohexyl)cyclohexane
CID 160925592
1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene
CID 162198901
1-ethoxy-2,3-difluoro-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]benzene
CID 118965777
1-butoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-[4-(4-butylcyclohexyl)phenyl]-2,3-difluoro-4-propoxybenzene;1-[4-(4-butylcyclohexyl)phenyl]-4-ethoxy-2,3-difluorobenzene;2,3-difluoro-1-propoxy-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-pentylcyclohexyl)phenyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluoro-4-methylbenzene
CID 158921345
1-[4-(2,3-difluoro-4-pentoxyphenyl)phenyl]-2,3-difluoro-4-(4-propylcyclohexyl)benzene
CID 67730650
2,3-difluoro-1-pentoxy-4-[4-(4-propylcyclohexyl)phenyl]benzene
CID 134358507
1-butoxy-2,3-difluoro-4-[4-(4-propylphenyl)phenyl]benzene;1-(4-butylcyclohexyl)-4-(4-ethylphenyl)benzene;1-butyl-2,3-difluoro-4-[4-(4-propylphenyl)phenyl]benzene;2,3-difluoro-1,4-bis(4-propylphenyl)benzene;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)cyclohexyl]-2,3-difluorobenzene;1-ethyl-4-[4-(4-pentylcyclohexyl)cyclohexyl]benzene;1-ethyl-4-(4-propylcyclohexyl)cyclohexane;1-ethyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene;1-ethyl-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-methyl-4-(4-pentylcyclohexyl)cyclohexane;1-methyl-4-(4-pentylphenyl)benzene
CID 160964790
1-(4-butylcyclohexyl)-4-ethoxy-2,3-difluorobenzene
CID 53418384
1-[4-(2,3-difluoro-4-octoxyphenyl)phenyl]-2,3-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 67738142
1-[4-(2,3-difluoro-4-heptoxyphenyl)phenyl]-2,3-difluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 67738139
1-ethoxy-4-[4-(4-ethylcyclohexyl)-2,3-difluorophenyl]-2,3-difluorobenzene
CID 134358646
2,3-difluoro-1-octoxy-4-[4-(4-pentylcyclohexyl)phenyl]benzene
CID 14495692

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene?
The IUPAC name of 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene (CID 158062229) is 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene.
What is the SMILES notation for 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene?
The canonical SMILES for 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene is CCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1.CCCCC1CCC(c2ccc(-c3ccc(CC)cc3)c(F)c2F)CC1.CCOc1ccc(-c2ccc(C3CCC(CC)CC3)cc2)c(F)c1F.
What is the InChIKey of 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene?
The InChIKey is FKUDDHFDEPLCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30F2.C23H28F2O.C23H28F2.C22H26F2O/c1-3-5-6-18-9-13-20(14-10-18)22-16-15-21(23(25)24(22)26)19-11-7-17(4-2)8-12-19;1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24;1-3-5-17-8-12-19(13-9-17)21-15-14-20(22(24)23(21)25)18-10-6-16(4-2)7-11-18;1-3-15-5-7-16(8-6-15)17-9-11-18(12-10-17)19-13-14-20(25-4-2)22(24)21(19)23/h7-8,11-12,15-16,18,20H,3-6,9-10,13-14H2,1-2H3;10-17H,3-9H2,1-2H3;6-7,10-11,14-15,17,19H,3-5,8-9,12-13H2,1-2H3;9-16H,3-8H2,1-2H3.
What are the key properties of 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene?
1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene has a molecular weight of 1401.89 g/mol, XLogP of 28.75, 22 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)-4-(4-ethylphenyl)-2,3-difluorobenzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-ethoxy-4-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluorobenzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylcyclohexyl)benzene is sourced from PubChem (CID 158062229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).