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4-Nitro-N-phenyl-3-pyridinamine

HCID 20184009
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Basic information

CAS
13505-03-8
Standard SMILES
O=[N+]([O-])c1ccncc1Nc1ccccc1
InChIKey
RTJKRQDHLDFASW-UHFFFAOYSA-N
Molecular formula
C11H9N3O2
Average molar mass
215.21 g/mol
Monoisotopic mass
215.06947654

Names & identifiers

Preferred name
4-Nitro-N-phenyl-3-pyridinamine
IUPAC
4-nitro-N-phenylpyridin-3-amine

Names & synonyms

4-Nitro-N-phenyl-3-pyridinamine13505-03-8SCHEMBL108154374-nitro-N-phenylpyridin-3-amineDTXSID401304227

Database identifiers

CAS
13505-03-8
PubChem CID
20184009
DTXSID
DTXSID401304227

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
70.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
236

Related reactions

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Compound notes

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