4-Benzylaniline
Properties
- Molecular formula
- C13H13N
- Molar mass
- 183.25 g/mol
- Exact mass
- 183.1048 Da
- logP
- 2.86Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed12.5% of notifiers
- H312 Harmful in contact with skin12.5% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled12.5% of notifiers
- H335 May cause respiratory irritation87.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1135-12-2SMILES
C1=CC=C(C=C1)CC2=CC=C(C=C2)NInChIKey
WDTRNCFZFQIWLM-UHFFFAOYSA-NInChI
InChI=1S/C13H13N/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10,14H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Benzenamine, 4-(phenylmethyl)-
Work with 4-Benzylaniline
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
4,4′-Methylenedianiline101-77-979 % similar
3,4'-Diaminodiphenylmethane19430-83-268 % similar
Diphenylmethane101-81-563 % similar
4-(4-Pyridylmethyl)aniline27692-74-660 % similar
4,4′-Ethylenedianiline621-95-457 % similar
P-Benzylbiphenyl613-42-357 % similar
4-Benzyloxyaniline6373-46-256 % similar
Polyaniline25233-30-155 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.