2-Chloro-4-hydroxybenzonitrile

C7H4ClNOCAS 3336-16-1153.56 g/mol

HOClN
Aryl halideNitrilePhenol

Properties

Molecular formula
C7H4ClNO
Molar mass
153.56 g/mol
Exact mass
152.9981 Da
logP
1.92Crippen estimate
Polar surface area
44.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 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
3336-16-1
SMILES
C1=CC(=C(C=C1O)Cl)C#N
InChIKey
BDDVAWDNVWLHDQ-UHFFFAOYSA-N
InChI
InChI=1S/C7H4ClNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H

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

Work with 2-Chloro-4-hydroxybenzonitrile

Similar compounds

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

Same formula

Elsewhere