2-Methyl-3-nitropyridine
Properties
- Molecular formula
- C6H6N2O2
- Molar mass
- 138.13 g/mol
- Exact mass
- 138.0429 Da
- logP
- 1.30Crippen estimate
- Polar surface area
- 56.0 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Warning
- H302+H332 Harmful if swallowed or if inhaled33.3% of notifiers
- H302 Harmful if swallowed33.3% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled33.3% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 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
18699-87-1SMILES
CC1=C(C=CC=N1)[N+](=O)[O-]InChIKey
CCFGTKQIRWHYTB-UHFFFAOYSA-NInChI
InChI=1S/C6H6N2O2/c1-5-6(8(9)10)3-2-4-7-5/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Methyl-3-nitropyridine
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
2-Methoxy-3-nitropyridine20265-35-463 % similar
2,3-Dimethyl-4-nitropyridine68707-69-762 % similar
2-Fluoro-3-nitropyridine1480-87-159 % similar
3-Methyl-2-nitropyridine18368-73-559 % similar
2-Bromo-3-nitropyridine19755-53-459 % similar
2-Chloro-3-nitropyridine34515-82-759 % similar
3-Nitro-2(1H)-pyridinethione38240-29-859 % similar
2-Amino-3-nitropyridine4214-75-959 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.