4-Cyanobenzyl chloride
Properties
- Molecular formula
- C8H6ClN
- Molar mass
- 151.59 g/mol
- Exact mass
- 151.0189 Da
- Melting point
- 80–81 °C
- logP
- 2.30Crippen estimate
- Polar surface area
- 23.8 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H302 Harmful if swallowed97.7% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, P501
Identifiers
CAS number
874-86-2SMILES
N#Cc1ccc(CCl)cc1InChIKey
LOQLDQJTSMKBJU-UHFFFAOYSA-NInChI
InChI=1S/C8H6ClN/c9-5-7-1-3-8(6-10)4-2-7/h1-4H,5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- Benzonitrile, 4-(chloromethyl)-
- p-Tolunitrile, α-chloro-
- 4-(Chloromethyl)benzonitrile
- p-Cyanobenzyl chloride
- 4-(Chloromethyl)benzeneacetonitrile
- α-Chloro-p-tolunitrile
- α-Chloro-p-toluonitrile
- p-(Chloromethyl)benzonitrile
- (4-Cyanophenyl)methyl chloride
- NSC 44855
- NSC 6307
- α-Chloro-p-cyanotoluene
Work with 4-Cyanobenzyl chloride
Similar compounds
4,4'-(1-Methylene) bis-benzonitrile10466-37-263 % similar
3-(Chloromethyl)benzonitrile64407-07-459 % similar
4-(Hydroxymethyl)benzonitrile874-89-558 % similar
Alpha,alpha'-Dichloro-p-xylene623-25-657 % similar
1,4-Dicyanobenzene623-26-757 % similar
4-Cyanobenzylamine10406-25-456 % similar
4-Cyanobenzyl bromide17201-43-356 % similar
4-Ethylbenzonitrile25309-65-356 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.