2-Amino-3-nitro-6-picoline

C₆H₇N₃O₂CAS 21901-29-1153.14 g/mol

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Nitro Primary amine

Properties

Molecular formula: C₆H₇N₃O₂
Molar mass: 153.14 g/mol
Exact mass: 153.0538 Da
logP: 0.88Crippen estimate
Polar surface area: 82.0 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed97.5% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled97.5% of notifiers

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

Precautionary statements

P233, P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P501

Identifiers

CAS number

21901-29-1

SMILES

CC1=NC(=C(C=C1)[N+](=O)[O-])N

InChIKey

LCJXSRQGDONHRK-UHFFFAOYSA-N

InChI

InChI=1S/C6H7N3O2/c1-4-2-3-5(9(10)11)6(7)8-4/h2-3H,1H3,(H2,7,8)

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Names and synonyms

1 names

2-Amino-6-methyl-3-nitropyridine

Work with 2-Amino-3-nitro-6-picoline

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

2,6-Dimethyl-3-nitropyridine15513-52-765 % similar 2-Amino-6-chloro-3-nitropyridine136901-10-561 % similar 2-Fluoro-6-methyl-3-nitropyridine19346-45-361 % similar 2-Amino-6-chloro-3-nitropyridine27048-04-061 % similar 2-Bromo-6-methyl-3-nitropyridine374633-31-561 % similar 2-Chloro-6-methyl-3-nitropyridine56057-19-361 % similar 6-Bromo-3-nitro-2-pyridinamine84487-04-761 % similar 6-Methoxy-3-nitro-2-pyridinamine73896-36-361 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Nitrophenyl)hydrazine100-16-3 1-Hydroxy-1H-benzotriazole hydrate (1:?)123333-53-9 6-Hydrazinonicotinic acid133081-24-0 5-Aminopyrazine-2-carboxylic acid methyl ester13924-94-2 N4-Acetylcytosine14631-20-0 2-Amino-3-(methoxycarbonyl)pyrazine16298-03-6 2-Amino-3-methyl-5-nitropyridine18344-51-9 2-Amino-5-nitro-4-picoline21901-40-6

Elsewhere

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