5-Chloro-2-hydroxybenzonitrile
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
- H302+H312 Harmful if swallowed or in contact with skin95% of notifiers
- H302 Harmful if swallowed97.5% of notifiers
- H312 Harmful in contact with skin97.5% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation97.5% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501
Identifiers
CAS number
13589-72-5SMILES
C1=CC(=C(C=C1Cl)C#N)OInChIKey
XWQDMIXVAYAZGB-UHFFFAOYSA-NInChI
InChI=1S/C7H4ClNO/c8-6-1-2-7(10)5(3-6)4-9/h1-3,10HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 5-Chloro-2-hydroxybenzonitrile
Similar compounds
2,5-Dichlorobenzonitrile21663-61-660 % similar
5-Bromo-2-hydroxybenzonitrile40530-18-556 % similar
5-Chloro-2-methylbenzonitrile50712-70-456 % similar
5-Chloro-2-fluorobenzonitrile57381-34-756 % similar
2-Amino-5-chlorobenzonitrile5922-60-156 % similar
2,4-Dichlorobenzonitrile6574-98-755 % similar
4-Chlorocatechol2138-22-954 % similar
2-Hydroxybenzonitrile611-20-152 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds