chempirical

3-Hydroxybenzyl alcohol

C7H8O2CAS 620-24-6124.14 g/mol

Open in Covalent MOL file
HOOH
AlcoholPhenol

Properties

Molecular formula
C7H8O2
Molar mass
124.14 g/mol
Exact mass
124.0524 Da
Melting point
73 °C
logP
0.88Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
620-24-6
SMILES
OCc1cccc(O)c1
InChIKey
OKVJCVWFVRATSG-UHFFFAOYSA-N
InChI
InChI=1S/C7H8O2/c8-5-6-2-1-3-7(9)4-6/h1-4,8-9H,5H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Benzenemethanol, 3-hydroxy-
  • Benzyl alcohol, m-hydroxy-
  • 3-Hydroxybenzenemethanol
  • KSD 2405
  • m-Hydroxybenzyl alcohol
  • 3-(Hydroxymethyl)phenol
  • NSC 60735

Work with 3-Hydroxybenzyl alcohol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Benzenedimethanol626-18-668 % similar 3-Hydroxybenzeneethanol13398-94-263 % similar 3-Ethylphenol620-17-759 % similar 3,5-Dihydroxybenzyl alcohol29654-55-558 % similar 3-Fluorobenzyl alcohol456-47-356 % similar 3-Chlorobenzyl alcohol873-63-256 % similar Meta-tyramine588-05-655 % similar 3-(Hydroxymethyl)benzonitrile874-97-555 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,6-Dimethyl-γ-pyrone1004-36-0 2-Acetyl-5-methylfuran1193-79-9 3-Methoxyphenol150-19-6 4-Methoxyphenol150-76-5 5-Ethyl-2-furaldehyde23074-10-4 (3Ar,6as)-3,3A,6,6A-tetrahydro-2H-cyclopenta[B]furan-2-one43119-28-4 4-Methylcatechol452-86-8 2,5-Cyclohexadiene-1-carboxylic acid4794-04-1

Elsewhere

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