2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol

C20H24O — CID 79841974

IUPAC2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol
SMILESCC1(C)CCCCC1(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H24O/c1-19(2)14-6-7-15-20(19,21)18-12-10-17(11-13-18)16-8-4-3-5-9-16/h3-5,8-13,21H,6-7,14-15H2,1-2H3
InChIKeySGYOILQOLZYHEF-UHFFFAOYSA-N
MW280.41 g/mol
LogP5.14
Rot. Bonds2

About 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol

2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol (PubChem CID 79841974) has the molecular formula C20H24O and a molecular weight of 280.41 g/mol. Its IUPAC name is 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol
PubChem CID79841974
Molecular FormulaC20H24O
Molecular Weight280.41 g/mol
Exact Mass280.18
IUPAC Name2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol
SMILESCC1(C)CCCCC1(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H24O/c1-19(2)14-6-7-15-20(19,21)18-12-10-17(11-13-18)16-8-4-3-5-9-16/h3-5,8-13,21H,6-7,14-15H2,1-2H3
InChIKeySGYOILQOLZYHEF-UHFFFAOYSA-N
XLogP5.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.41
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol?
The IUPAC name of 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol (CID 79841974) is 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol.
What is the SMILES notation for 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol?
The canonical SMILES for 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol is CC1(C)CCCCC1(O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol?
The InChIKey is SGYOILQOLZYHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O/c1-19(2)14-6-7-15-20(19,21)18-12-10-17(11-13-18)16-8-4-3-5-9-16/h3-5,8-13,21H,6-7,14-15H2,1-2H3.
What are the key properties of 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol?
2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol has a molecular weight of 280.41 g/mol, XLogP of 5.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(4-phenylphenyl)cyclohexan-1-ol is sourced from PubChem (CID 79841974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).