2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene

C33H42 — CID 175465233

IUPAC2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
SMILESCC(C)c1cc(C(C)C)c(-c2ccccc2C2CCCCC2)c(C(C)C)c1-c1ccccc1
InChIInChI=1S/C33H42/c1-22(2)29-21-30(23(3)4)33(31(24(5)6)32(29)26-17-11-8-12-18-26)28-20-14-13-19-27(28)25-15-9-7-10-16-25/h8,11-14,17-25H,7,9-10,15-16H2,1-6H3
InChIKeyAUWZGMMJVYFOOL-UHFFFAOYSA-N
MW438.70 g/mol
LogP10.44
Rot. Bonds6

About 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene

2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene (PubChem CID 175465233) has the molecular formula C33H42 and a molecular weight of 438.70 g/mol. Its IUPAC name is 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene.

Molecular Properties

Compound Name2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
PubChem CID175465233
Molecular FormulaC33H42
Molecular Weight438.70 g/mol
Exact Mass438.33
IUPAC Name2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
SMILESCC(C)c1cc(C(C)C)c(-c2ccccc2C2CCCCC2)c(C(C)C)c1-c1ccccc1
InChIInChI=1S/C33H42/c1-22(2)29-21-30(23(3)4)33(31(24(5)6)32(29)26-17-11-8-12-18-26)28-20-14-13-19-27(28)25-15-9-7-10-16-25/h8,11-14,17-25H,7,9-10,15-16H2,1-6H3
InChIKeyAUWZGMMJVYFOOL-UHFFFAOYSA-N
XLogP10.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.70
LogP ≤ 510.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-diphenyl-1,3,5-tri(propan-2-yl)benzene
CID 158905708
1,3-dicyclohexyl-5-phenyl-2,4,6-tri(propan-2-yl)benzene
CID 175032315
diphenyl-[2-[3-phenyl-2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
CID 122414026
ditert-butyl-[2-[3-phenyl-2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
CID 122414025
1-cyclobutyl-2-phenylbenzene
CID 23453799
2-(2-iodo-3-methoxyphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene
CID 121483081
9-(2,6-dicyclohexylphenyl)-10-[2,4,6-tri(propan-2-yl)phenyl]anthracene
CID 142358364
1,3,5-triphenyl-2,4,6-tri(propan-2-yl)benzene
CID 175984465
2-cyclopentyl-1,4-diphenylnaphthalene
CID 15981874
2-cyclohexyl-6-propan-2-ylphenol
CID 3058302
(1R)-1-[2-(2-cyclobutylphenyl)phenyl]ethanol
CID 71129039
2,9-bis(2-cyclohexylphenyl)-4,7-diphenyl-1,10-phenanthroline
CID 22972033

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene?
The IUPAC name of 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene (CID 175465233) is 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene.
What is the SMILES notation for 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene?
The canonical SMILES for 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene is CC(C)c1cc(C(C)C)c(-c2ccccc2C2CCCCC2)c(C(C)C)c1-c1ccccc1.
What is the InChIKey of 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene?
The InChIKey is AUWZGMMJVYFOOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H42/c1-22(2)29-21-30(23(3)4)33(31(24(5)6)32(29)26-17-11-8-12-18-26)28-20-14-13-19-27(28)25-15-9-7-10-16-25/h8,11-14,17-25H,7,9-10,15-16H2,1-6H3.
What are the key properties of 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene?
2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene has a molecular weight of 438.70 g/mol, XLogP of 10.44, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylphenyl)-4-phenyl-1,3,5-tri(propan-2-yl)benzene is sourced from PubChem (CID 175465233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).