(3-phenylcyclohex-3-en-1-yl)methanol

C13H16O — CID 15185954

IUPAC(3-phenylcyclohex-3-en-1-yl)methanol
SMILESOCC1CCC=C(c2ccccc2)C1
InChIInChI=1S/C13H16O/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-3,6-8,11,14H,4-5,9-10H2
InChIKeyVWBFPVHBMWAKAM-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.86
Rot. Bonds2

About (3-phenylcyclohex-3-en-1-yl)methanol

(3-phenylcyclohex-3-en-1-yl)methanol (PubChem CID 15185954) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is (3-phenylcyclohex-3-en-1-yl)methanol.

Molecular Properties

Compound Name(3-phenylcyclohex-3-en-1-yl)methanol
PubChem CID15185954
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name(3-phenylcyclohex-3-en-1-yl)methanol
SMILESOCC1CCC=C(c2ccccc2)C1
InChIInChI=1S/C13H16O/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-3,6-8,11,14H,4-5,9-10H2
InChIKeyVWBFPVHBMWAKAM-UHFFFAOYSA-N
XLogP2.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Phenylethanol
CID 6054
Benzenepropanol
CID 31234
1-Phenyl-3-methyl-3-pentanol
CID 61516
2-Methyl-4-phenyl-2-butanol
CID 7632
alpha-(2-Methylpropyl)benzeneethanol
CID 62661
2-Phenyl-1-propanol
CID 14295
4-Phenyl-2-butanol
CID 61302
5-Phenyl-1-pentanol
CID 61523
2-Pentylcinnamic alcohol
CID 5368491
Phenylisohexanol
CID 108312
1-Phenyl-2-pentanol
CID 61202
2-Pentyl-3-phenylprop-2-en-1-ol
CID 6076971

Frequently Asked Questions

What is the IUPAC name of (3-phenylcyclohex-3-en-1-yl)methanol?
The IUPAC name of (3-phenylcyclohex-3-en-1-yl)methanol (CID 15185954) is (3-phenylcyclohex-3-en-1-yl)methanol.
What is the SMILES notation for (3-phenylcyclohex-3-en-1-yl)methanol?
The canonical SMILES for (3-phenylcyclohex-3-en-1-yl)methanol is OCC1CCC=C(c2ccccc2)C1.
What is the InChIKey of (3-phenylcyclohex-3-en-1-yl)methanol?
The InChIKey is VWBFPVHBMWAKAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-3,6-8,11,14H,4-5,9-10H2.
What are the key properties of (3-phenylcyclohex-3-en-1-yl)methanol?
(3-phenylcyclohex-3-en-1-yl)methanol has a molecular weight of 188.27 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenylcyclohex-3-en-1-yl)methanol is sourced from PubChem (CID 15185954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).