Basic information
- CAS
27695-54-1- Standard SMILES
CCOC(Nc1ccc(C(=O)C(Br)Br)cc1)C(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
BIPTUBUPASUPHB-UHFFFAOYSA-N- Molecular formula
- C18H16Br2N2O5
- Average molar mass
- 500.1 g/mol
- Monoisotopic mass
- 497.9426
Names & identifiers
- Preferred name
- Ethanone, 2-((4-(dibromoacetyl)phenyl)amino)-2-ethoxy-1-(4-nitrophenyl)-
- IUPAC
- 2-[4-(2,2-dibromoacetyl)anilino]-2-ethoxy-1-(4-nitrophenyl)ethanone
Names & synonyms
BRN 27881662-((4-(Dibromoacetyl)phenyl)amino)-2-ethoxy-1-(4-nitrophenyl)ethanone27695-54-1Ketone, 2-((4-(dibromoacetyl)phenyl)amino)-2-ethoxy-1-(4-nitrophenyl)-ETHANONE, 2-((4-(DIBROMOACETYL)PHENYL)AMINO)-2-ETHOXY-1-(4-NITROPHENYL)-RefChem:341332DTXSID409503582,2-Dibromo-1-(4-{[1-ethoxy-2-(4-nitrophenyl)-2-oxoethyl]amino}phenyl)ethan-1-one
Database identifiers
- CAS
27695-54-1- PubChem CID
- 33985
- DTXSID
DTXSID40950358
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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