1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate

C263H324F14O20 — CID 158409313

IUPAC1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate
SMILESCc1ccc(-c2ccc(OC(F)(F)C3=C(F)CC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)C3CCC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)c3ccc(C)cc3)cc2)cc1.Cc1ccc(C2CCC(OC(F)(F)C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(/C=C/C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(CCC3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)c2ccc(/C=C/C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(CCC3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(F)(F)C2=C(F)CC(C)CC2)cc1.Cc1ccc(OC(F)(F)C2CCC(C)CC2)cc1
InChIInChI=1S/C23H34O2.C23H32O2.C23H28O2.C23H26O2.C21H21F3O.C21H30F2O.C21H24F2O.C21H18F2O.C21H30O2.C21H24O2.C15H17F3O.C15H20F2O.C15H20O2/c4*1-17-3-7-19(8-4-17)9-10-20-11-13-21(14-12-20)23(24)25-22-15-5-18(2)6-16-22;1-14-3-6-16(7-4-14)17-8-10-18(11-9-17)25-21(23,24)19-12-5-15(2)13-20(19)22;3*1-15-3-7-17(8-4-15)18-9-13-20(14-10-18)24-21(22,23)19-11-5-16(2)6-12-19;2*1-15-3-7-17(8-4-15)18-9-11-19(12-10-18)21(22)23-20-13-5-16(2)6-14-20;1-10-3-6-12(7-4-10)19-15(17,18)13-8-5-11(2)9-14(13)16;1-11-3-7-13(8-4-11)15(16,17)18-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14/h5-6,15-17,19-21H,3-4,7-14H2,1-2H3;5-6,9-10,15-17,19-21H,3-4,7-8,11-14H2,1-2H3;5-6,11-17,19H,3-4,7-10H2,1-2H3;5-6,9-17,19H,3-4,7-8H2,1-2H3;3-4,6-11,15H,5,12-13H2,1-2H3;3-4,7-8,16,18-20H,5-6,9-14H2,1-2H3;3-4,7-10,13-14,16,19H,5-6,11-12H2,1-2H3;3-14H,1-2H3;5-6,13-15,17-19H,3-4,7-12H2,1-2H3;5-6,9-15,17H,3-4,7-8H2,1-2H3;3-4,6-7,11H,5,8-9H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3/b;10-9+;;10-9+;;;;;;;;;
InChIKeyGZCFXOGJXZPRQS-JSKIKNDZSA-N
MW4071.44 g/mol
LogP74.69
Rot. Bonds48

About 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate

1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate (PubChem CID 158409313) has the molecular formula C263H324F14O20 and a molecular weight of 4071.44 g/mol. Its IUPAC name is 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate.

Molecular Properties

Compound Name1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate
PubChem CID158409313
Molecular FormulaC263H324F14O20
Molecular Weight4071.44 g/mol
Exact Mass4068.41
IUPAC Name1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate
SMILESCc1ccc(-c2ccc(OC(F)(F)C3=C(F)CC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)C3CCC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)c3ccc(C)cc3)cc2)cc1.Cc1ccc(C2CCC(OC(F)(F)C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(/C=C/C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(CCC3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)c2ccc(/C=C/C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(CCC3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(F)(F)C2=C(F)CC(C)CC2)cc1.Cc1ccc(OC(F)(F)C2CCC(C)CC2)cc1
InChIInChI=1S/C23H34O2.C23H32O2.C23H28O2.C23H26O2.C21H21F3O.C21H30F2O.C21H24F2O.C21H18F2O.C21H30O2.C21H24O2.C15H17F3O.C15H20F2O.C15H20O2/c4*1-17-3-7-19(8-4-17)9-10-20-11-13-21(14-12-20)23(24)25-22-15-5-18(2)6-16-22;1-14-3-6-16(7-4-14)17-8-10-18(11-9-17)25-21(23,24)19-12-5-15(2)13-20(19)22;3*1-15-3-7-17(8-4-15)18-9-13-20(14-10-18)24-21(22,23)19-11-5-16(2)6-12-19;2*1-15-3-7-17(8-4-15)18-9-11-19(12-10-18)21(22)23-20-13-5-16(2)6-14-20;1-10-3-6-12(7-4-10)19-15(17,18)13-8-5-11(2)9-14(13)16;1-11-3-7-13(8-4-11)15(16,17)18-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14/h5-6,15-17,19-21H,3-4,7-14H2,1-2H3;5-6,9-10,15-17,19-21H,3-4,7-8,11-14H2,1-2H3;5-6,11-17,19H,3-4,7-10H2,1-2H3;5-6,9-17,19H,3-4,7-8H2,1-2H3;3-4,6-11,15H,5,12-13H2,1-2H3;3-4,7-8,16,18-20H,5-6,9-14H2,1-2H3;3-4,7-10,13-14,16,19H,5-6,11-12H2,1-2H3;3-14H,1-2H3;5-6,13-15,17-19H,3-4,7-12H2,1-2H3;5-6,9-15,17H,3-4,7-8H2,1-2H3;3-4,6-7,11H,5,8-9H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3/b;10-9+;;10-9+;;;;;;;;;
InChIKeyGZCFXOGJXZPRQS-JSKIKNDZSA-N
XLogP74.69
TPSA239.48 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds48
Heavy Atoms297
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004071.44
LogP ≤ 574.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

1-[difluoro-[2-fluoro-4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexen-1-yl]methoxy]-4-methylbenzene;1-[difluoro-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]phenyl]methoxy]-4-methylbenzene
CID 90916538
(3-fluoro-4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(3-fluoro-4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;1,2,3-trimethyl-5-(4-methylcyclohexyl)benzene;1,2,3-trimethyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2,3-trimethyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2,3-trimethyl-5-[4-(4-methylcyclohexyl)phenyl]benzene;1,2,3-trimethyl-5-(4-methylphenyl)benzene;1,2,3-trimethyl-5-[4-(4-methylphenyl)phenyl]benzene
CID 158044869
1-methyl-4-[2-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]ethyl]benzene;1-methyl-4-[2-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]ethyl]benzene;[4-(4-methylphenoxy)carbonylcyclohexyl] 4-methylcyclohexane-1-carboxylate;[4-[2-(4-methylphenyl)ethyl]cyclohexyl] 4-methylcyclohexane-1-carboxylate
CID 91535010
2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]-1-[2-(4-methylphenyl)ethynyl]benzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;2-fluoro-4-(4-methylcyclohexyl)-1-[2-(4-methylphenyl)ethynyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[2-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]ethynyl]benzene;1-methyl-4-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]benzene;(4-methylphenyl) 4-(4-methylcyclohexanecarbonyl)oxybenzoate
CID 159008864
(4-methylphenyl) 4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzoate
CID 59938822
1,3-difluoro-2-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,3-difluoro-2-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1,3-difluoro-2-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]benzene;2-fluoro-1-methyl-4-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;2-fluoro-1-methyl-4-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]benzene;(3-fluoro-4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;1-methyl-4-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-methyl-4-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]benzene;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate
CID 160899076
1-[2-[4-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]cyclohexyl]ethyl]-4-methylbenzene
CID 59938802
(4-fluorophenyl) 4-[difluoro-[4-[(E)-2-(4-propylcyclohexyl)ethenyl]cyclohexyl]methoxy]cyclohexane-1-carboxylate
CID 122502291
(4-cyano-3-fluorophenyl) 4-(4-methylcyclohexyl)benzoate;[4-(4-cyanophenyl)phenyl] 4-(4-methylcyclohexyl)benzoate;[4-(4-cyanophenyl)phenyl] 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(3,4-difluorophenyl) 4-methylcyclohexane-1-carboxylate;2-(3,4-difluorophenyl)-5-methylpyrimidine;2-fluoro-4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzonitrile;(4-fluorophenyl) 4-methylcyclohexane-1-carboxylate;2-(4-fluorophenyl)-5-methylpyrimidine;2-[4-(4-fluorophenyl)phenyl]-5-methylpyrimidine;4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzonitrile;4-[4-(4-methylphenyl)phenyl]benzonitrile;4-[5-(4-methylphenyl)pyrimidin-2-yl]benzonitrile
CID 159706781
(4-cyano-3-fluorophenyl) 4-(4-methylcyclohexyl)benzoate;[4-(4-cyanophenyl)phenyl] 4-(4-methylcyclohexyl)benzoate;[4-(4-cyanophenyl)phenyl] 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;2-(3,4-difluorophenyl)-5-methylpyrimidine;2-fluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzonitrile;2-fluoro-4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzonitrile;2-fluoro-4-[4-(4-methylcyclohexyl)phenyl]benzonitrile;2-(4-fluorophenyl)-5-methylpyrimidine;2-[4-(4-fluorophenyl)phenyl]-5-methylpyrimidine;4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzonitrile;4-[4-(4-methylcyclohexyl)phenyl]benzonitrile;4-[4-(4-methylphenyl)phenyl]benzonitrile;4-[5-(4-methylphenyl)pyrimidin-2-yl]benzonitrile
CID 160511813
1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)cyclohexen-1-yl]methoxy]-4-(4-methylphenyl)benzene
CID 59938814
(4-propylphenyl) 4-[(E)-2-[4-(4-propoxycyclohexyl)cyclohexyl]ethenyl]benzoate
CID 20717280

Frequently Asked Questions

What is the IUPAC name of 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate?
The IUPAC name of 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate (CID 158409313) is 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate.
What is the SMILES notation for 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate?
The canonical SMILES for 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate is Cc1ccc(-c2ccc(OC(F)(F)C3=C(F)CC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)C3CCC(C)CC3)cc2)cc1.Cc1ccc(-c2ccc(OC(F)(F)c3ccc(C)cc3)cc2)cc1.Cc1ccc(C2CCC(OC(F)(F)C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(/C=C/C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C)CC2)cc1.Cc1ccc(OC(=O)C2CCC(C3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)C2CCC(CCC3CCC(C)CC3)CC2)cc1.Cc1ccc(OC(=O)c2ccc(/C=C/C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(=O)c2ccc(CCC3CCC(C)CC3)cc2)cc1.Cc1ccc(OC(F)(F)C2=C(F)CC(C)CC2)cc1.Cc1ccc(OC(F)(F)C2CCC(C)CC2)cc1.
What is the InChIKey of 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate?
The InChIKey is GZCFXOGJXZPRQS-JSKIKNDZSA-N. The full InChI is InChI=1S/C23H34O2.C23H32O2.C23H28O2.C23H26O2.C21H21F3O.C21H30F2O.C21H24F2O.C21H18F2O.C21H30O2.C21H24O2.C15H17F3O.C15H20F2O.C15H20O2/c4*1-17-3-7-19(8-4-17)9-10-20-11-13-21(14-12-20)23(24)25-22-15-5-18(2)6-16-22;1-14-3-6-16(7-4-14)17-8-10-18(11-9-17)25-21(23,24)19-12-5-15(2)13-20(19)22;3*1-15-3-7-17(8-4-15)18-9-13-20(14-10-18)24-21(22,23)19-11-5-16(2)6-12-19;2*1-15-3-7-17(8-4-15)18-9-11-19(12-10-18)21(22)23-20-13-5-16(2)6-14-20;1-10-3-6-12(7-4-10)19-15(17,18)13-8-5-11(2)9-14(13)16;1-11-3-7-13(8-4-11)15(16,17)18-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)15(16)17-14-9-5-12(2)6-10-14/h5-6,15-17,19-21H,3-4,7-14H2,1-2H3;5-6,9-10,15-17,19-21H,3-4,7-8,11-14H2,1-2H3;5-6,11-17,19H,3-4,7-10H2,1-2H3;5-6,9-17,19H,3-4,7-8H2,1-2H3;3-4,6-11,15H,5,12-13H2,1-2H3;3-4,7-8,16,18-20H,5-6,9-14H2,1-2H3;3-4,7-10,13-14,16,19H,5-6,11-12H2,1-2H3;3-14H,1-2H3;5-6,13-15,17-19H,3-4,7-12H2,1-2H3;5-6,9-15,17H,3-4,7-8H2,1-2H3;3-4,6-7,11H,5,8-9H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3;5-6,9-11,13H,3-4,7-8H2,1-2H3/b;10-9+;;10-9+;;;;;;;;;.
What are the key properties of 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate?
1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate has a molecular weight of 4071.44 g/mol, XLogP of 74.69, 48 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-methylbenzene;1-[difluoro-(2-fluoro-4-methylcyclohexen-1-yl)methoxy]-4-(4-methylphenyl)benzene;1-[4-[difluoro-(4-methylcyclohexyl)methoxy]cyclohexyl]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-methylbenzene;1-[difluoro-(4-methylcyclohexyl)methoxy]-4-(4-methylphenyl)benzene;1-[difluoro-(4-methylphenyl)methoxy]-4-(4-methylphenyl)benzene;(4-methylphenyl) 4-methylcyclohexane-1-carboxylate;(4-methylphenyl) 4-(4-methylcyclohexyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]benzoate;(4-methylphenyl) 4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexane-1-carboxylate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]benzoate;(4-methylphenyl) 4-[2-(4-methylcyclohexyl)ethyl]cyclohexane-1-carboxylate is sourced from PubChem (CID 158409313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).