Basic information
- CAS
119-76-6- Standard SMILES
CC(=O)Nc1ccc([N+](=O)[O-])c(NC(C)=O)c1- InChIKey
BBPXRFUIVJRWKY-UHFFFAOYSA-N- Molecular formula
- C10H11N3O4
- Average molar mass
- 237.21 g/mol
- Monoisotopic mass
- 237.07495584
Names & identifiers
- Preferred name
- Acetamide, N,N'-(4-nitro-1,3-phenylene)bis-
- IUPAC
- N-(3-acetamido-4-nitrophenyl)acetamide
- English name
- N,N'-(4-nitro-1,3-phenylene)bis(acetamide)
- Molecular formula
- C10H11N3O4
- Molecular weight
- 237.21
Names & synonyms
EINECS 204-349-1Acetamide, N,N'-(4-nitro-1,3-phenylene)bis-N,N'-(4-Nitro-1,3-phenylene)bis(acetamide)DTXSID6059495N,N'-(4-Nitro-1,3-phenylene)bis[acetamide]RefChem:108804DTXCID4033473204-349-1119-76-6N-(3-acetamido-4-nitrophenyl)acetamiden,n'-(4-nitro-1,3-phenylene)diacetamideN,N/'-(4-nitro-1,3-phenylene)bis(acetamide)
Show more names
2,4-Di(acetylamino)-1-nitrobenzene1,3-Bis(acetylamino)-4-nitrobenzeneN,N'-Diacetyl-4-nitro-m-phenylenediamine4-Nitro-N,N'-diacetyl-1,3-benzenediamine
SCHEMBL10790188BBPXRFUIVJRWKY-UHFFFAOYSA-NAKOS003889648N-[5-(acetylamino)-2-nitrophenyl]acetamideNS00023882ST51007810
Database identifiers
- CAS
119-76-6- PubChem CID
- 67073
- DTXSID
DTXSID6059495- EC Number
- 204-349-1
- Nikkaji
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Boiling point
- 548.9 · 548.9±45.0 °C(Predicted)
- Density
- 1.416 · 1.416±0.06 g/cm3(Predicted)
- pka
- 13.42 · 13.42±0.70(Predicted)
- EPA Substance Registry System
- Acetamide, N,N'-(4-nitro-1,3-phenylene)bis- (119-76-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetamide, N,N'-(4-nitro-1,3-phenylene)bis-: INACTIVE
Suppliers1 total
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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