N-(4-(aminocarbonyl)phenyl)-4-nitrobenzamide
Basic information
- CAS
93839-21-5- Standard SMILES
NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1- InChIKey
FANLHXKNWWSLIG-UHFFFAOYSA-N- Molecular formula
- C14H11N3O4
- Average molar mass
- 285.25 g/mol
- Monoisotopic mass
- 285.07495584
Names & identifiers
- Preferred name
- N-(4-(aminocarbonyl)phenyl)-4-nitrobenzamide
- IUPAC
- 4-[(4-nitrobenzoyl)amino]benzamide
- English name
- N-[4-(aminocarbonyl)phenyl]-4-nitrobenzamide
- Molecular formula
- C14H11N3O4
- Molecular weight
- 285.25
Names & synonyms
N-[4-(aminocarbonyl)phenyl]-4-nitrobenzamide93839-21-5EINECS 298-791-2N-(4-(Aminocarbonyl)phenyl)-4-nitrobenzamideEC 298-791-2DTXSID80239730RefChem:162054DTXCID30162221298-791-2N-(4-carbamoylphenyl)-4-nitrobenzamide4-[(4-nitrobenzoyl)amino]benzamideN-(4-CARBAMOYLPHENYL)-4-NITRO-BENZAMIDE
Show more names
N-[4-(Aminocarbonyl)phenyl]-4-nitrobenzamidBenzamide, N-[4-(aminocarbonyl)phenyl]-4-nitro-
QF6HT8H3R4Oprea1_331145Oprea1_357864FANLHXKNWWSLIG-UHFFFAOYSA-NSTK180690AKOS0006042004-[(4-nitrophenyl)carbonylamino]benzamideST4000799
Database identifiers
- CAS
93839-21-5- PubChem CID
- 689161
- DTXSID
DTXSID80239730- UNII
- QF6HT8H3R4
- EC Number
- 298-791-2
- Nikkaji
- J317.603G
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 405
Physicochemical properties
- Boiling point
- 448.6 · 448.6±30.0 °C(Predicted)
- Density
- 1.434 · 1.434±0.06 g/cm3(Predicted)
- pka
- 11.65 · 11.65±0.70(Predicted)
- form
- Powder
- LogP
- 1.45 at · 1.45 at 23℃ and pH7
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Warning
- Hazard statements
- 341 · H341
- Precautionary statements
- 201 · P201-P202-P281-P308+P313-P405-P501
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 83.3% (5 of 6) of all reports.
Warning
H341 (16.7%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationREACH registered substance: N-[4-(aminocarbonyl)phenyl]-4-nitrobenzamide (EC: 298-791-2)
Hazard Classes and CategoriesMuta. 2 (16.7%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS08
- Hazard statements
- H341
- REACH Registrations
- Active
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…