2-Amino-6-chloro-3-nitropyridine

C₅H₄ClN₃O₂CAS 27048-04-0173.56 g/mol

Open in Covalent MOL file

Aryl halide Nitro Primary amine

Properties

Molecular formula: C₅H₄ClN₃O₂
Molar mass: 173.56 g/mol
Exact mass: 172.9992 Da
logP: 1.23Crippen estimate
Polar surface area: 82.0 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed21.1% of notifiers
H312 Harmful in contact with skin21.1% of notifiers
H315 Causes skin irritation94.7% of notifiers
H319 Causes serious eye irritation94.7% of notifiers
H332 Harmful if inhaled21.1% of notifiers
H335 May cause respiratory irritation89.5% of notifiers

Aggregated from 19 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

27048-04-0

SMILES

Nc1nc(Cl)ccc1[N+](=O)[O-]

InChIKey

WERABQRUGJIMKQ-UHFFFAOYSA-N

InChI

InChI=1S/C5H4ClN3O2/c6-4-2-1-3(9(10)11)5(7)8-4/h1-2H,(H2,7,8)

Weigh it out

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

Names and synonyms

7 names

2-Pyridinamine, 6-chloro-3-nitro-
Pyridine, 2-amino-6-chloro-3-nitro-
6-Chloro-3-nitro-2-pyridinamine
6-Amino-2-chloro-5-nitropyridine
6-Chloro-3-nitro-2-pyridylamine
6-Chloro-3-nitropyridin-2-ylamine
2-Amino-3-nitro-6-chloropyridine

Work with 2-Amino-6-chloro-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

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.

2-Amino-6-chloro-3-nitropyridine136901-10-5

Similar compounds

2,6-Dichloro-3-nitropyridine16013-85-765 % similar 2-Amino-3-nitro-6-picoline21901-29-161 % similar 6-Chloro-2-methyl-3-nitropyridine22280-60-061 % similar 6-Bromo-3-nitro-2-pyridinamine84487-04-761 % similar 6-Chloro-2-methoxy-3-nitropyridine40851-91-056 % similar 6-Methoxy-3-nitro-2-pyridinamine73896-36-356 % similar 6-Chloro-3-nitropyridine-2-carbonitrile93683-65-956 % similar 2-Amino-3-nitropyridine4214-75-951 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-5-nitropyridin-2-amine24484-96-6 2-Chloro-5-nitropyridin-4-amine2604-39-9 3-Amino-6-chloropyrazine-2-carboxylic acid2727-13-1 4-Amino-2-chloro-3-nitropyridine2789-25-5 2-Amino-5-chloro-3-nitropyridine409-39-2 2-Amino-5-chloro-3-nitropyridine5409-39-2 2-Amino-4-chloro-3-nitropyridine6980-08-1

Elsewhere

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