4-Cyanopyridine N-oxide
Properties
- Molecular formula
- C6H4N2O
- Molar mass
- 120.11 g/mol
- Exact mass
- 120.0324 Da
- Melting point
- 223–225 °C
- logP
- 0.19Crippen estimate
- Polar surface area
- 50.7 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
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 irritation100% of notifiers
- H332 Harmful if inhaled100% of notifiers
- H335 May cause respiratory irritation97.5% 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
14906-59-3SMILES
N#Cc1cc[n+]([O-])cc1InChIKey
QNCSFBSIWVBTHE-UHFFFAOYSA-NInChI
InChI=1S/C6H4N2O/c7-5-6-1-3-8(9)4-2-6/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 4-Pyridinecarbonitrile, 1-oxide
- Isonicotinonitrile, 1-oxide
- 4-Cyanopyridine 1-oxide
- 4-Cyanopyridine oxide
- NSC 132883
- 1-Oxopyridine-4-carbonitrile
- 1-Oxidopyridin-1-ium-4-carbonitrile
Work with 4-Cyanopyridine N-oxide
Similar compounds
1,4-Dicyanobenzene623-26-752 % similar
Benzonitrile100-47-048 % similar
4-Phenylpyridine 1-oxide1131-61-946 % similar
(1,1'-Biphenyl)-4,4'-dicarbonitrile1591-30-646 % similar
4-Cyanopyridine100-48-142 % similar
4-Methylpyridine N-oxide1003-67-442 % similar
4-Chloropyridine N-oxide1121-76-242 % similar
4-Bromopyridine N-oxide14248-50-142 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.