Basic information
- CAS
5442-74-0- Standard SMILES
CC(=O)Nc1ccc([As](=O)(O)O)cc1[N+](=O)[O-]- InChIKey
VBTPMPMANQBFAK-UHFFFAOYSA-N- Molecular formula
- C8H9AsN2O6
- Average molar mass
- 304.09 g/mol
- Monoisotopic mass
- 303.967656
Names & identifiers
- Preferred name
- (4-Acetamido-3-nitrophenyl)arsonic acid
- IUPAC
- (4-acetamido-3-nitrophenyl)arsonic acid
Names & synonyms
NSC137695442-74-0(4-acetamido-3-nitrophenyl)arsonic acidANTINEOPLASTIC-13769DTXSID00279698NSC-13769
Database identifiers
- CAS
5442-74-0- PubChem CID
- 224908
- DTXSID
DTXSID00279698
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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