2-Hydroxy-4-methyl-3-nitropyridine

C6H6N2O3CAS 21901-18-8154.12 g/mol

Open in Covalent MOL file
ONHN+OO−
Nitro

Properties

Molecular formula
C6H6N2O3
Molar mass
154.12 g/mol
Exact mass
154.0378 Da
logP
0.59Crippen estimate
Polar surface area
76.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
21901-18-8
SMILES
CC1=C(C(=O)NC=C1)[N+](=O)[O-]
InChIKey
HZCWTTHQRMHIIE-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N2O3/c1-4-2-3-7-6(9)5(4)8(10)11/h2-3H,1H3,(H,7,9)

Weigh it out

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

Work with 2-Hydroxy-4-methyl-3-nitropyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chloro-2-hydroxy-3-nitropyridine165547-79-561 % similar 3-Nitropyridine-2,4-diol89282-12-261 % similar 2,6-Dimethylnitrobenzene81-20-955 % similar 5-Bromo-2-hydroxy-3-nitro-4-picoline228410-90-049 % similar 2,3-Dinitrotoluene602-01-749 % similar Nitromesitylene603-71-449 % similar 3-Bromo-2-nitrotoluene52414-97-847 % similar 1-Chloro-3-methyl-2-nitrobenzene5367-26-047 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Nitro-3-methylpyridine N-oxide1074-98-2 4-Amino-2-nitrophenol119-34-6 2-Amino-5-nitrophenol121-88-0 3-Acetyl-1H-pyrazole-5-carboxylic acid1297537-45-1 6-Methyl-2-nitropyridin-3-ol15128-90-2 2-Methoxy-3-nitropyridine20265-35-4 3-Methoxy-2-nitropyridine20265-37-6 3-Methyl-5-nitro-2(1H)-pyridinone21901-34-8

Elsewhere

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