cyclohexane;2-(hydroxymethyl)phenol

C13H20O2 — CID 174697635

IUPACcyclohexane;2-(hydroxymethyl)phenol
SMILESC1CCCCC1.OCc1ccccc1O
InChIInChI=1S/C7H8O2.C6H12/c8-5-6-3-1-2-4-7(6)9;1-2-4-6-5-3-1/h1-4,8-9H,5H2;1-6H2
InChIKeyQANWDPJMRWMGBR-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.23
Rot. Bonds1

About cyclohexane;2-(hydroxymethyl)phenol

cyclohexane;2-(hydroxymethyl)phenol (PubChem CID 174697635) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is cyclohexane;2-(hydroxymethyl)phenol.

Molecular Properties

Compound Namecyclohexane;2-(hydroxymethyl)phenol
PubChem CID174697635
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Namecyclohexane;2-(hydroxymethyl)phenol
SMILESC1CCCCC1.OCc1ccccc1O
InChIInChI=1S/C7H8O2.C6H12/c8-5-6-3-1-2-4-7(6)9;1-2-4-6-5-3-1/h1-4,8-9H,5H2;1-6H2
InChIKeyQANWDPJMRWMGBR-UHFFFAOYSA-N
XLogP3.23
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(hydroxymethyl)phenol;methane
CID 157439231
CID 137424646
CID 137424646
calcium;hydride;2-(hydroxymethyl)phenol
CID 173090882
formaldehyde;2-(hydroxymethyl)phenol
CID 69155710
2-(hydroxymethyl)phenol;pentane
CID 70619203
2-(hydroxymethyl)phenol;bis(pyrrolidine-1-carboxylic acid)
CID 118271940
[2-(hydroxymethyl)phenyl]methanol;methane
CID 143282166
CID 11620727
CID 11620727
benzene-1,2-diol;cyclohexane
CID 175415805
2-[[2-(hydroxymethyl)anilino]methyl]phenol
CID 43743175
CID 175749710
CID 175749710
2-(cyclobutylmethyl)phenol
CID 115012772

Frequently Asked Questions

What is the IUPAC name of cyclohexane;2-(hydroxymethyl)phenol?
The IUPAC name of cyclohexane;2-(hydroxymethyl)phenol (CID 174697635) is cyclohexane;2-(hydroxymethyl)phenol.
What is the SMILES notation for cyclohexane;2-(hydroxymethyl)phenol?
The canonical SMILES for cyclohexane;2-(hydroxymethyl)phenol is C1CCCCC1.OCc1ccccc1O.
What is the InChIKey of cyclohexane;2-(hydroxymethyl)phenol?
The InChIKey is QANWDPJMRWMGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O2.C6H12/c8-5-6-3-1-2-4-7(6)9;1-2-4-6-5-3-1/h1-4,8-9H,5H2;1-6H2.
What are the key properties of cyclohexane;2-(hydroxymethyl)phenol?
cyclohexane;2-(hydroxymethyl)phenol has a molecular weight of 208.30 g/mol, XLogP of 3.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;2-(hydroxymethyl)phenol is sourced from PubChem (CID 174697635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).