3-Amino-4-nitropyridine

HCID 586943CAS 13505-02-7

Basic information

Standard SMILES
Nc1cnccc1[N+](=O)[O-]
InChIKey
SXIUYRNIWXQXEA-UHFFFAOYSA-N
Molecular formula
C5H5N3O2
Average molar mass
139.11 g/mol
Monoisotopic mass
139.0381764

Names & identifiers

Preferred name
3-Amino-4-nitropyridine
IUPAC
4-nitropyridin-3-amine
English name
4-NITRO-PYRIDIN-3-YLAMINE
Molecular formula
C5H5N3O2
Molecular weight
139.11

Names & synonyms

4-nitropyridin-3-amine3-Amino-4-nitropyridine13505-02-74-NITRO-PYRIDIN-3-YLAMINE3-Pyridinamine, 4-nitro-MFCD041142324-nitro-pyridin-3ylamine3-amino4-nitropyridine4-Nitro-3-pyridinamine #SCHEMBL1284068SCHEMBL3200434DTXSID80343048
Show more names
4-nitro-3-PyridinaMine4-NITRO-3-AMINOPYRIDINE3-Amino-4-nitropyridine97%3-AMINO-4-NITROPYRIDINE 97%3-Pyridinamine,4-nitro-(9CI)4-NITRO-PYRIDIN-3-YLAMINE ISO 9001:2015 REACH
CS1212AKOS006339143AKOS015891668AB18008AC-25134DS-11153SY007782DB-022227

Database identifiers

CAS
13505-02-7
PubChem CID
586943
DTXSID
DTXSID80343048
Nikkaji
J985.075I

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
84.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Melting point
138 °C · 138 °C(Solv: water (7732-18-5))
Boiling point
358.2 · 358.2±22.0 °C(Predicted)
Density
1.437 · 1.437±0.06 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
2.25 · 2.25±0.18(Predicted)
Appearance
Yellow to orange Solid

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313

Chemistry & industry

Suppliers50 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
环生美森医药技术(山东)有限公司0531-88762217 18301471076 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Related reactions

4 records

Linked notes

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