2-cyclohexyl-4-decyl-6-methylphenol

C23H38O — CID 174344111

IUPAC2-cyclohexyl-4-decyl-6-methylphenol
SMILESCCCCCCCCCCc1cc(C)c(O)c(C2CCCCC2)c1
InChIInChI=1S/C23H38O/c1-3-4-5-6-7-8-9-11-14-20-17-19(2)23(24)22(18-20)21-15-12-10-13-16-21/h17-18,21,24H,3-16H2,1-2H3
InChIKeyNRVDOIWLZMTECQ-UHFFFAOYSA-N
MW330.56 g/mol
LogP7.43
Rot. Bonds10

About 2-cyclohexyl-4-decyl-6-methylphenol

2-cyclohexyl-4-decyl-6-methylphenol (PubChem CID 174344111) has the molecular formula C23H38O and a molecular weight of 330.56 g/mol. Its IUPAC name is 2-cyclohexyl-4-decyl-6-methylphenol.

Molecular Properties

Compound Name2-cyclohexyl-4-decyl-6-methylphenol
PubChem CID174344111
Molecular FormulaC23H38O
Molecular Weight330.56 g/mol
Exact Mass330.29
IUPAC Name2-cyclohexyl-4-decyl-6-methylphenol
SMILESCCCCCCCCCCc1cc(C)c(O)c(C2CCCCC2)c1
InChIInChI=1S/C23H38O/c1-3-4-5-6-7-8-9-11-14-20-17-19(2)23(24)22(18-20)21-15-12-10-13-16-21/h17-18,21,24H,3-16H2,1-2H3
InChIKeyNRVDOIWLZMTECQ-UHFFFAOYSA-N
XLogP7.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.56
LogP ≤ 57.43
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

4-[(3-cyclohexyl-4-hydroxy-5-methylphenyl)methyl]-2-hexylnaphthalen-1-ol
CID 139607697
2-cyclopentyl-1,3-dimethyl-5-pentylbenzene
CID 176571033
2,6-dimethyl-4-octadecylphenol
CID 66619575
4-hexatriacontyl-2,6-dimethylphenol
CID 71335537
2-tert-butyl-4-[8-(3-tert-butyl-5-cyclohexyl-4-hydroxyphenyl)octyl]-6-cyclohexylphenol
CID 19003383
2-cyclohexyl-4-(methoxymethyl)-6-methylphenol
CID 143901397
2,6-dimethyl-4-pentylphenol
CID 22625507
2-cyclohexyl-4-[1-(3-cyclohexyl-4-hydroxy-5-methylphenyl)butyl]-6-methylphenol
CID 19940310
2,6-dicyclohexyl-4-[1-(3,5-dicyclohexyl-4-hydroxyphenyl)heptyl]phenol
CID 139824888
4-[6-(4-hydroxy-3,5-dimethylphenyl)hexyl]-2,6-dimethylphenol
CID 174910624
2,6-dicyclohexyl-4-[1-(3,5-dicyclohexyl-4-hydroxyphenyl)hexyl]phenol
CID 139824988
2-cyclohexyl-4-[2-(3-cyclohexyl-4-hydroxy-5-methylphenyl)propan-2-yl]-6-methylphenol
CID 21020610

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-decyl-6-methylphenol?
The IUPAC name of 2-cyclohexyl-4-decyl-6-methylphenol (CID 174344111) is 2-cyclohexyl-4-decyl-6-methylphenol.
What is the SMILES notation for 2-cyclohexyl-4-decyl-6-methylphenol?
The canonical SMILES for 2-cyclohexyl-4-decyl-6-methylphenol is CCCCCCCCCCc1cc(C)c(O)c(C2CCCCC2)c1.
What is the InChIKey of 2-cyclohexyl-4-decyl-6-methylphenol?
The InChIKey is NRVDOIWLZMTECQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38O/c1-3-4-5-6-7-8-9-11-14-20-17-19(2)23(24)22(18-20)21-15-12-10-13-16-21/h17-18,21,24H,3-16H2,1-2H3.
What are the key properties of 2-cyclohexyl-4-decyl-6-methylphenol?
2-cyclohexyl-4-decyl-6-methylphenol has a molecular weight of 330.56 g/mol, XLogP of 7.43, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-decyl-6-methylphenol is sourced from PubChem (CID 174344111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).