Basic information
- CAS
286440-05-9- Standard SMILES
O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1- InChIKey
REDLORXULQJGAK-UHFFFAOYSA-N- Molecular formula
- C14H11ClN2O3
- Average molar mass
- 290.7 g/mol
- Monoisotopic mass
- 290.0458199
Names & identifiers
- Preferred name
- N-(4-chlorophenyl)-2-(4-nitrophenyl)acetamide
- IUPAC
- N-(4-chlorophenyl)-2-(4-nitrophenyl)acetamide
Names & synonyms
N-(4-chlorophenyl)-2-(4-nitrophenyl)acetamide286440-05-9MLS000689163SMR000283290N1-(4-chlorophenyl)-2-(4-nitrophenyl)acetamideN-(4-chlorophenyl)-2-{4-nitrophenyl}acetamideOprea1_069213Oprea1_150649cid_698255SCHEMBL4733997CHEMBL1455697BDBM55779
Show more names
DTXSID401324293HMS2729N15CCG-1579STK395981AKOS000677826DA-42900ST50727613N-(4-chlorophenyl)-2-(4-nitrophenyl)ethanamide
Database identifiers
- CAS
286440-05-9- PubChem CID
- 698255
- DTXSID
DTXSID401324293- ChEMBL
CHEMBL1455697
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
Experimental & physicochemical properties
Solubility4.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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