2-(4-hydroxyphenyl)cyclohexan-1-one

C12H14O2 — CID 14548752

IUPAC2-(4-hydroxyphenyl)cyclohexan-1-one
SMILESO=C1CCCCC1c1ccc(O)cc1
InChIInChI=1S/C12H14O2/c13-10-7-5-9(6-8-10)11-3-1-2-4-12(11)14/h5-8,11,13H,1-4H2
InChIKeyFWAHEVVMELQPIJ-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.62
Rot. Bonds1

About 2-(4-hydroxyphenyl)cyclohexan-1-one

2-(4-hydroxyphenyl)cyclohexan-1-one (PubChem CID 14548752) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)cyclohexan-1-one.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)cyclohexan-1-one
PubChem CID14548752
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name2-(4-hydroxyphenyl)cyclohexan-1-one
SMILESO=C1CCCCC1c1ccc(O)cc1
InChIInChI=1S/C12H14O2/c13-10-7-5-9(6-8-10)11-3-1-2-4-12(11)14/h5-8,11,13H,1-4H2
InChIKeyFWAHEVVMELQPIJ-UHFFFAOYSA-N
XLogP2.62
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)cyclohexan-1-one?
The IUPAC name of 2-(4-hydroxyphenyl)cyclohexan-1-one (CID 14548752) is 2-(4-hydroxyphenyl)cyclohexan-1-one.
What is the SMILES notation for 2-(4-hydroxyphenyl)cyclohexan-1-one?
The canonical SMILES for 2-(4-hydroxyphenyl)cyclohexan-1-one is O=C1CCCCC1c1ccc(O)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)cyclohexan-1-one?
The InChIKey is FWAHEVVMELQPIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c13-10-7-5-9(6-8-10)11-3-1-2-4-12(11)14/h5-8,11,13H,1-4H2.
What are the key properties of 2-(4-hydroxyphenyl)cyclohexan-1-one?
2-(4-hydroxyphenyl)cyclohexan-1-one has a molecular weight of 190.24 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)cyclohexan-1-one is sourced from PubChem (CID 14548752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).