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1-Triazene, 3-methyl-1,3-bis(4-nitrophenyl)-

HCID 579017
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Basic information

CAS
16978-82-8
Standard SMILES
CN(N=Nc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1
InChIKey
SOAWPNGIWQTSEH-UHFFFAOYSA-N
Molecular formula
C13H11N5O4
Average molar mass
301.26 g/mol
Monoisotopic mass
301.08110385

Names & identifiers

Preferred name
1-Triazene, 3-methyl-1,3-bis(4-nitrophenyl)-
IUPAC
N-methyl-4-nitro-N-[(4-nitrophenyl)diazenyl]aniline

Names & synonyms

1-Triazene, 3-methyl-1,3-bis(4-nitrophenyl)-16978-82-8DTXSID30342147SOAWPNGIWQTSEH-CCEZHUSRSA-NAKOS000656460ST51174791Triazene, 3-methyl-1,3-bis(4-nitrophenyl)-SR-01000314907(1E)-3-Methyl-1,3-bis(4-nitrophenyl)triaz-1-eneSR-01000314907-13-METHYL-1,3-BIS(4-NITROPHENYL)TRIAZ-1-ENE(1E)-3-Methyl-1,3-bis(4-nitrophenyl)-1-triazene #

Database identifiers

CAS
16978-82-8
PubChem CID
579017
DTXSID
DTXSID30342147

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
120 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
417

Related reactions

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Compound notes

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