2-Hydroxy-4-nitrobenzonitrile
Properties
- Molecular formula
- C7H4N2O3
- Molar mass
- 164.12 g/mol
- Exact mass
- 164.0222 Da
- logP
- 1.17Crippen estimate
- Polar surface area
- 87.2 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed50% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 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
39835-14-8SMILES
C1=CC(=C(C=C1[N+](=O)[O-])O)C#NInChIKey
DZNPHVPBCNZVGW-UHFFFAOYSA-NInChI
InChI=1S/C7H4N2O3/c8-4-5-1-2-6(9(11)12)3-7(5)10/h1-3,10HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Hydroxy-4-nitrobenzonitrile
Similar compounds
4-Nitrophthalonitrile31643-49-971 % similar
2-Cyano-4-nitroaniline17420-30-363 % similar
2-Chloro-4-nitrobenzonitrile28163-00-063 % similar
2-Fluoro-4-nitrobenzonitrile34667-88-463 % similar
4-Nitrocatechol3316-09-462 % similar
2-Bromo-5-nitrobenzonitrile134604-07-259 % similar
2-Chloro-5-nitrobenzonitrile16588-02-659 % similar
2-Fluoro-5-nitrobenzonitrile17417-09-359 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds