4-Benzylphenol
Properties
- Molecular formula
- C13H12O
- Molar mass
- 184.24 g/mol
- Exact mass
- 184.0888 Da
- Melting point
- 84 °C
- Boiling point
- 322 °C
- logP
- 2.98Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
101-53-1SMILES
Oc1ccc(Cc2ccccc2)cc1InChIKey
HJSPWKGEPDZNLK-UHFFFAOYSA-NInChI
InChI=1S/C13H12O/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9,14H,10H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- Phenol, 4-(phenylmethyl)-
- p-Cresol, α-phenyl-
- 4-(Phenylmethyl)phenol
- p-Benzylphenol
- 4-Hydroxyditane
- α-Phenyl-p-cresol
- Fesiasept
- p-Hydroxydiphenyl methane
- 4-Hydroxydiphenylmethane
- AI 3-1932
- NSC 8078
- 1-Hydroxy-4-(phenylmethyl)benzene
Work with 4-Benzylphenol
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Bisphenol F620-92-879 % similar
Diphenylmethane101-81-563 % similar
1-Benzyl-4-bromobenzene2116-36-158 % similar
P-Benzylbiphenyl613-42-357 % similar
3-(4-Hydroxyphenyl)-1-propanol10210-17-056 % similar
Phenol108-95-255 % similar
Tyrosol501-94-054 % similar
4-(Benzylamino)phenol103-14-054 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds