1-(1-phenylcyclohexyl)ethanol

C14H20O — CID 57301582

IUPAC1-(1-phenylcyclohexyl)ethanol
SMILESCC(O)C1(c2ccccc2)CCCCC1
InChIInChI=1S/C14H20O/c1-12(15)14(10-6-3-7-11-14)13-8-4-2-5-9-13/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3
InChIKeyQZZWLLJAUUMFDV-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.27
Rot. Bonds2

About 1-(1-phenylcyclohexyl)ethanol

1-(1-phenylcyclohexyl)ethanol (PubChem CID 57301582) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-(1-phenylcyclohexyl)ethanol.

Molecular Properties

Compound Name1-(1-phenylcyclohexyl)ethanol
PubChem CID57301582
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-(1-phenylcyclohexyl)ethanol
SMILESCC(O)C1(c2ccccc2)CCCCC1
InChIInChI=1S/C14H20O/c1-12(15)14(10-6-3-7-11-14)13-8-4-2-5-9-13/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3
InChIKeyQZZWLLJAUUMFDV-UHFFFAOYSA-N
XLogP3.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclohexyl)ethanol?
The IUPAC name of 1-(1-phenylcyclohexyl)ethanol (CID 57301582) is 1-(1-phenylcyclohexyl)ethanol.
What is the SMILES notation for 1-(1-phenylcyclohexyl)ethanol?
The canonical SMILES for 1-(1-phenylcyclohexyl)ethanol is CC(O)C1(c2ccccc2)CCCCC1.
What is the InChIKey of 1-(1-phenylcyclohexyl)ethanol?
The InChIKey is QZZWLLJAUUMFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-12(15)14(10-6-3-7-11-14)13-8-4-2-5-9-13/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3.
What are the key properties of 1-(1-phenylcyclohexyl)ethanol?
1-(1-phenylcyclohexyl)ethanol has a molecular weight of 204.31 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclohexyl)ethanol is sourced from PubChem (CID 57301582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).