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N-Nitro-3-pyridazinamine

HCID 20073099
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Basic information

CAS
867130-35-6
Standard SMILES
O=[N+]([O-])Nc1cccnn1
InChIKey
QJVNDYBOEUIOMU-UHFFFAOYSA-N
Molecular formula
C4H4N4O2
Average molar mass
140.1 g/mol
Monoisotopic mass
140.03342538

Names & identifiers

Preferred name
N-Nitro-3-pyridazinamine
IUPAC
N-pyridazin-3-ylnitramide

Names & synonyms

N-Nitro-3-pyridazinamine867130-35-6N-pyridazin-3-ylnitramideSCHEMBL9869877DTXSID901313318

Database identifiers

CAS
867130-35-6
PubChem CID
20073099
DTXSID
DTXSID901313318

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
83.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
123

Related reactions

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Compound notes

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