Basic information
- Standard SMILES
O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1- InChIKey
LZBOEAUDEFYCDQ-UHFFFAOYSA-N- Molecular formula
- C13H9N3O5
- Average molar mass
- 287.23 g/mol
- Monoisotopic mass
- 287.0542204
Names & identifiers
- Preferred name
- Benzamide, 4-nitro-N-(3-nitrophenyl)-
- IUPAC
- 4-nitro-N-(3-nitrophenyl)benzamide
- English name
- 3',4-dinitrobenzanilide
- Molecular formula
- C13H9N3O5
- Molecular weight
- 287.22766
Names & synonyms
Benzamide, 4-nitro-N-(3-nitrophenyl)-139-29-7EINECS 205-357-8DTXSID8059685RefChem:561472DTXCID60345044-nitro-N-(3-nitrophenyl)benzamide3',4-DinitrobenzanilideOprea1_125661Oprea1_438111SCHEMBL8710919STK022158
Show more names
AKOS0014833414-Nitro-N-(3-nitro-phenyl)-benzamideNS00024501ST50693157(4-nitrophenyl)-N-(3-nitrophenyl)carboxamide
Database identifiers
- CAS
139-29-7- PubChem CID
- 67315
- DTXSID
DTXSID8059685- EC Number
- 205-357-8
- Nikkaji
- J184.414H
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 409
Physicochemical properties
- EPA Substance Registry System
- 4 · Benzamide, 4-nitro-N-(3-nitrophenyl)- (139-29-7)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzamide, 4-nitro-N-(3-nitrophenyl)-: INACTIVE
Suppliers3 total
济南启源生物科技有限公司18766124282; 18766124282 · [email protected]
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Related reactions
1 records
Linked notes
Loading…