Basic information
- CAS
5410-33-3- Standard SMILES
Nc1nc2cc([As](=O)(O)O)ccc2o1- InChIKey
VJDFAUVYVRTQNX-UHFFFAOYSA-N- Molecular formula
- C7H7AsN2O4
- Average molar mass
- 258.06 g/mol
- Monoisotopic mass
- 257.962176
Names & identifiers
- Preferred name
- (2-Amino-1,3-benzoxazol-5-yl)arsonic acid
- IUPAC
- (2-amino-1,3-benzoxazol-5-yl)arsonic acid
Names & synonyms
5410-33-3(2-amino-1,3-benzoxazol-5-yl)arsonic acidNSC12616ANTINEOPLASTIC-12616DTXSID70279408NSC-12616
Database identifiers
- CAS
5410-33-3- PubChem CID
- 224252
- DTXSID
DTXSID70279408
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…