1-(4-cyclohexylphenyl)octan-1-ol

C20H32O — CID 63426970

IUPAC1-(4-cyclohexylphenyl)octan-1-ol
SMILESCCCCCCCC(O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C20H32O/c1-2-3-4-5-9-12-20(21)19-15-13-18(14-16-19)17-10-7-6-8-11-17/h13-17,20-21H,2-12H2,1H3
InChIKeyICKRZZPSTWJLRO-UHFFFAOYSA-N
MW288.48 g/mol
LogP6.13
Rot. Bonds8

About 1-(4-cyclohexylphenyl)octan-1-ol

1-(4-cyclohexylphenyl)octan-1-ol (PubChem CID 63426970) has the molecular formula C20H32O and a molecular weight of 288.48 g/mol. Its IUPAC name is 1-(4-cyclohexylphenyl)octan-1-ol.

Molecular Properties

Compound Name1-(4-cyclohexylphenyl)octan-1-ol
PubChem CID63426970
Molecular FormulaC20H32O
Molecular Weight288.48 g/mol
Exact Mass288.25
IUPAC Name1-(4-cyclohexylphenyl)octan-1-ol
SMILESCCCCCCCC(O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C20H32O/c1-2-3-4-5-9-12-20(21)19-15-13-18(14-16-19)17-10-7-6-8-11-17/h13-17,20-21H,2-12H2,1H3
InChIKeyICKRZZPSTWJLRO-UHFFFAOYSA-N
XLogP6.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.48
LogP ≤ 56.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(4-cyclopentylphenyl)hexan-1-ol
CID 91233072
1-(4-cyclopropylphenyl)octan-1-ol
CID 79980004
1-(4-cyclohexylphenyl)hexan-1-amine
CID 43125388
1-[4-(3-fluorocyclopentyl)phenyl]hexan-1-ol
CID 70970008
1-[4-[(1S,2S)-2-chlorocyclopentyl]phenyl]hexan-1-ol
CID 143942234
6-(4-cycloheptylphenyl)-N,6-dihydroxyhexanamide
CID 23503080
2-bromo-1-(4-cyclohexylphenyl)ethanol
CID 116863188
2-amino-1-(4-cyclohexylphenyl)ethanol
CID 82114264
1-(3-cyclopropylphenyl)decan-1-ol
CID 79980400
1-(3-cyclopropylphenyl)octan-1-ol
CID 79981026
1-(4-cyclobutylphenyl)-2-methylhexan-1-ol
CID 114247193
1-(4-cyclohexylphenyl)-N-methylpentan-1-amine
CID 43484983

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylphenyl)octan-1-ol?
The IUPAC name of 1-(4-cyclohexylphenyl)octan-1-ol (CID 63426970) is 1-(4-cyclohexylphenyl)octan-1-ol.
What is the SMILES notation for 1-(4-cyclohexylphenyl)octan-1-ol?
The canonical SMILES for 1-(4-cyclohexylphenyl)octan-1-ol is CCCCCCCC(O)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 1-(4-cyclohexylphenyl)octan-1-ol?
The InChIKey is ICKRZZPSTWJLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32O/c1-2-3-4-5-9-12-20(21)19-15-13-18(14-16-19)17-10-7-6-8-11-17/h13-17,20-21H,2-12H2,1H3.
What are the key properties of 1-(4-cyclohexylphenyl)octan-1-ol?
1-(4-cyclohexylphenyl)octan-1-ol has a molecular weight of 288.48 g/mol, XLogP of 6.13, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylphenyl)octan-1-ol is sourced from PubChem (CID 63426970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).