CAS 3537-14-2 5-Nitropyridine-2,3-diamine (HCID 3480151)

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Basic information

CAS: 3537-14-2
Standard SMILES: Nc1cc([N+](=O)[O-])cnc1N
InChIKey: JOQJNCSAEMIZOU-UHFFFAOYSA-N
Molecular formula: C5H6N4O2
Average molar mass: 154.13 g/mol
Monoisotopic mass: 154.04907543

Names & identifiers

Preferred name: 5-Nitropyridine-2,3-diamine
IUPAC: 5-nitropyridine-2,3-diamine
English name: 5-NITROPYRIDINE-2,3-DIAMINE
Molecular formula: C5H6N4O2
Molecular weight: 154.13

Names & synonyms

5-nitropyridine-2,3-diamineDTXSID00392871RefChem:537447DTXCID50343732854-635-03537-14-25-Nitro-2,3-pyridinediamine2,3-diamino-5-nitropyridineMFCD106976972,3-Pyridinediamine, 5-nitro-NSC 107296NSC107296

Show more names

5-NITROPYRIDINE-2,3-DIAMINE ISO 9001：2015 REACH

SCHEMBL9874752,3-diamino-5-nitro-pyridineJOQJNCSAEMIZOU-UHFFFAOYSA-NAKOS006302948AB60270NSC-107296AC-27083DA-17020

Database identifiers

CAS: 3537-14-2
PubChem CID: 3480151
DTXSID: DTXSID00392871
EC Number: 854-635-0

Properties

Computed structural properties

XLogP: -0.3
Topological polar surface area: 111 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 157

Physicochemical properties

Melting point: 260 °C · 260 °C
Boiling point: 476.1 · 476.1±40.0 °C(Predicted)
Density: 1.555 · 1.555±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
pka: 2.7 · 2.70±0.49(Predicted)
Appearance: Pink to red Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H335-H315-H332-H312-H319
Precautionary statements: 280 · P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H335-H315-H332-H312-H319
Precautionary statements: P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P