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2-Nitropyridin-4-amine

CAT: 0572-TRC-N519890-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N519890-250MGSize:250 mg
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CAS Number
14916-64-4
Synonyms
4-Amino-2-nitro-pyridine
Hazard Statement
No Data Available
Smiles
O=N(C1=NC=CC(N)=C1)=O
Molecular Formula
C5H5N3O2
Molecular Weight
139.11
InChI
InChI=1S/C5H5N3O2/c6-4-1-2-7-5(3-4)8(9)10/h1-3H,(H2,6,7)
Additionnal Information
IUPAC name: 2-nitropyridin-4-amine
Shipping Conditions
Room Temperature

Chemical Information

4-Amino-2-nitropyridine
CAS Number14916-64-4
PubChem CID564459
IUPAC Name2-nitropyridin-4-amine
Molecular FormulaC5H5N3O2
Molecular Weight139.11
XLogP0
Topological Polar Surface Area84.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity133
SMILES
C1=CN=C(C=C1N)[N+](=O)[O-]
InChI
InChI=1S/C5H5N3O2/c6-4-1-2-7-5(3-4)8(9)10/h1-3H,(H2,6,7)
InChIKey
ZPFUWAVLEWIOEJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Amino-2-nitropyridine
CAS: 14916-64-4
CID: 564459
Formula: C5H5N3O2
MW: 139.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight139.11
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass139.038176411
Monoisotopic Mass139.038176411
Topological Polar Surface Area84.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity133
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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