4-Arsenoso-2-nitroanisole
Basic information
- CAS
5410-85-5- Standard SMILES
COc1ccc([As]=O)cc1[N+](=O)[O-]- InChIKey
SMFDUQPULPMANJ-UHFFFAOYSA-N- Molecular formula
- C7H6AsNO4
- Average molar mass
- 243.05 g/mol
- Monoisotopic mass
- 242.951277
Names & identifiers
- Preferred name
- 4-Arsenoso-2-nitroanisole
- IUPAC
- 4-arsoroso-1-methoxy-2-nitrobenzene
Names & synonyms
5410-85-54-Arsenoso-2-nitroanisoleNSC12691ANTINEOPLASTIC-12691Anisole, 4-arsenoso-2-nitro-NIOSH/BZ8420000DTXSID30968987(4-Methoxy-3-nitrophenyl)arsanoneNSC-12691BZ84200000
Database identifiers
- CAS
5410-85-5- PubChem CID
- 224313
- DTXSID
DTXSID30968987
Properties
Computed structural properties
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 205
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Compound notes
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