2-Amino-3-nitro-5-picoline

C₆H₇N₃O₂CAS 7598-26-7153.14 g/mol

Open in Covalent MOL file

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

Warning

H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled66.7% 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

7598-26-7

SMILES

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

InChIKey

ZJKGRSJMFDIRPX-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

1 names

5-Methyl-3-nitropyridin-2-amine

Work with 2-Amino-3-nitro-5-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

5-Fluoro-3-nitropyridin-2-amine212268-12-764 % similar 2-Chloro-5-methyl-3-nitropyridine23056-40-862 % similar 5-Iodo-3-nitro-2-pyridinamine25391-57-562 % similar 2-Amino-5-chloro-3-nitropyridine409-39-262 % similar 2-Amino-5-chloro-3-nitropyridine5409-39-262 % similar 5-Bromo-3-nitro-2-pyridinamine6945-68-262 % similar 4-Methyl-2-nitroaniline89-62-353 % similar 2,4-Dimethyl-6-nitroaniline1635-84-351 % 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-3-nitro-6-picoline21901-29-1

Elsewhere

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