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Benzamide, N-(2,4-dinitrophenyl)-4-nitro-

HCID 216712
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Basic information

CAS
37632-91-0
Standard SMILES
O=C(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1
InChIKey
HNTAKXSYJOAFSG-UHFFFAOYSA-N
Molecular formula
C13H8N4O7
Average molar mass
332.22 g/mol
Monoisotopic mass
332.03929861

Names & identifiers

Preferred name
Benzamide, N-(2,4-dinitrophenyl)-4-nitro-
IUPAC
N-(2,4-dinitrophenyl)-4-nitrobenzamide
English name
2'',4'',4-TRINITROBENZANILIDE
Molecular formula
C13H8N4O7
Molecular weight
332.227

Names & synonyms

N-(2,4-Dinitrophenyl)-4-nitrobenzamide37632-91-0BRN 2227734Benzanilide, 2',4,4'-trinitro-Benzamide, N-(2,4-dinitrophenyl)-4-nitro-DTXSID701910704-12-00-01700 (Beilstein Handbook Reference)RefChem:322143DTXCID80113561609-455-52'',4'',4-TRINITROBENZANILIDE2',4',4-trinitrobenzanilide
Show more names
SCHEMBL11189491AKOS001584769NS00030233Q4463120

Database identifiers

CAS
37632-91-0
PubChem CID
216712
DTXSID
DTXSID70191070
EC Number
609-455-5
Nikkaji
J2.706.859F

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
167 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
24
Formal charge
0
Complexity
516

Chemistry & industry

Upstream & downstream products

Downstream products

2-(4-Aminophenyl)-1H-benzimidazol-5-amine

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Compound notes

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