chempirical

2-Hydroxy-6-methyl-3-nitropyridine

C6H6N2O3CAS 39745-39-6154.13 g/mol

Open in Covalent MOL file
OHNN+OO−
Nitro

Properties

Molecular formula
C6H6N2O3
Molar mass
154.13 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

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
39745-39-6
SMILES
CC1=CC=C(C(=O)N1)[N+](=O)[O-]
InChIKey
YVYDGIGILRUPED-UHFFFAOYSA-N
InChI
InChI=1S/C6H6N2O3/c1-4-2-3-5(8(10)11)6(9)7-4/h2-3H,1H3,(H,7,9)

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Names and synonyms

1 names
  • 6-Hydroxy-5-nitro-2-picoline

Work with 2-Hydroxy-6-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

2-Hydroxy-6-methyl-5-nitropyridine28489-45-451 % similar 4-Hydroxy-6-methyl-3-nitro-2-pyridone4966-90-950 % similar DNQX2379-57-949 % similar 6-Methyl-5-nitro-2-pyridinamine22280-62-246 % similar 2-Hydroxy-5-methyl-3-nitropyridine7464-14-446 % similar 3-Bromo-2-hydroxy-6-picoline374633-33-746 % similar 3,4-Dinitrotoluene610-39-944 % similar 2,6-Dinitrotoluene606-20-243 % 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 3-Hydroxy-6-methyl-2-nitropyridine15128-90-2 2-Methoxy-3-nitropyridine20265-35-4 3-Methoxy-2-nitropyridine20265-37-6 2-Hydroxy-4-methyl-3-nitropyridine21901-18-8

Elsewhere

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