2-cyclohexylcyclohexa-2,4-dien-1-ol

C12H18O — CID 173193560

IUPAC2-cyclohexylcyclohexa-2,4-dien-1-ol
SMILESOC1CC=CC=C1C1CCCCC1
InChIInChI=1S/C12H18O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8,10,12-13H,1-3,6-7,9H2
InChIKeyJSNOPHSDRPNODV-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.81
Rot. Bonds1

About 2-cyclohexylcyclohexa-2,4-dien-1-ol

2-cyclohexylcyclohexa-2,4-dien-1-ol (PubChem CID 173193560) has the molecular formula C12H18O and a molecular weight of 178.28 g/mol. Its IUPAC name is 2-cyclohexylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name2-cyclohexylcyclohexa-2,4-dien-1-ol
PubChem CID173193560
Molecular FormulaC12H18O
Molecular Weight178.28 g/mol
Exact Mass178.14
IUPAC Name2-cyclohexylcyclohexa-2,4-dien-1-ol
SMILESOC1CC=CC=C1C1CCCCC1
InChIInChI=1S/C12H18O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8,10,12-13H,1-3,6-7,9H2
InChIKeyJSNOPHSDRPNODV-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylcyclohexa-2,4-dien-1-ol?
The IUPAC name of 2-cyclohexylcyclohexa-2,4-dien-1-ol (CID 173193560) is 2-cyclohexylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 2-cyclohexylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for 2-cyclohexylcyclohexa-2,4-dien-1-ol is OC1CC=CC=C1C1CCCCC1.
What is the InChIKey of 2-cyclohexylcyclohexa-2,4-dien-1-ol?
The InChIKey is JSNOPHSDRPNODV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8,10,12-13H,1-3,6-7,9H2.
What are the key properties of 2-cyclohexylcyclohexa-2,4-dien-1-ol?
2-cyclohexylcyclohexa-2,4-dien-1-ol has a molecular weight of 178.28 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 173193560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).