Basic information
- CAS
71501-31-0- Standard SMILES
O=C(Nc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl- InChIKey
HKFKBQGYOFOVFH-UHFFFAOYSA-N- Molecular formula
- C13H9ClN2O3
- Average molar mass
- 276.67 g/mol
- Monoisotopic mass
- 276.0301698
Names & identifiers
- Preferred name
- 2-Chloro-4-nitrobenzanilide
- IUPAC
- 2-chloro-4-nitro-N-phenylbenzamide
- English name
- 2-CHLORO-4-NITROBENZANILIDE
- Molecular formula
- C13H9ClN2O3
- Molecular weight
- 276.68
Names & synonyms
2-Chloro-4-nitrobenzanilide71501-31-02-chloro-4-nitro-n-phenylbenzamideQ5NX52RUW3EINECS 275-560-4NSC-158651DTXSID00221733NSC 158651BENZAMIDE, 2-CHLORO-4-NITRO-N-PHENYL-RefChem:86259DTXCID30144224275-560-4
Show more names
MFCD000170122-CHLORO-4-NITRO BENZANILIDENSC158651Benzamide,2-chloro-4-nitro-N-phenyl-UNII-Q5NX52RUW3SCHEMBL8310013HKFKBQGYOFOVFH-UHFFFAOYSA-N2-chloro-4-nitro-N-phenyl-benzamide
Database identifiers
- CAS
71501-31-0- PubChem CID
- 98684
- DTXSID
DTXSID00221733- UNII
- Q5NX52RUW3
- EC Number
- 275-560-4
- Nikkaji
- J289.184K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- solubility
- Chloroform, Methanol
- FDA UNII
- 5 NX52RUW3 · Q5NX52RUW3
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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