4-(Hydroxymethyl)benzonitrile
Properties
- Molecular formula
- C8H7NO
- Molar mass
- 133.15 g/mol
- Exact mass
- 133.0528 Da
- logP
- 1.05Crippen estimate
- Polar surface area
- 44.0 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation97.5% of notifiers
- H332 Harmful if inhaled100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 40 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
874-89-5SMILES
C1=CC(=CC=C1CO)C#NInChIKey
XAASLEJRGFPHEV-UHFFFAOYSA-NInChI
InChI=1S/C8H7NO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,10H,6H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- p-Cyanobenzyl alcohol
Work with 4-(Hydroxymethyl)benzonitrile
Similar compounds
4,4'-(1-Methylene) bis-benzonitrile10466-37-265 % similar
4-(2-Hydroxyethyl)benzonitrile69395-13-764 % similar
1,4-Benzenedimethanol589-29-760 % similar
1,4-Dicyanobenzene623-26-760 % similar
4-Cyanobenzylamine10406-25-458 % similar
4-Cyanobenzyl bromide17201-43-358 % similar
4-Ethylbenzonitrile25309-65-358 % similar
4-Cyanobenzyl chloride874-86-258 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.