Basic information
- CAS
5425-61-6- Standard SMILES
Cl.Nc1cc(C(=O)O)ccc1[As](Cl)Cl- InChIKey
KRDNBPZBRBNNSX-UHFFFAOYSA-N- Molecular formula
- C7H7AsCl3NO2
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 316.875831
Names & identifiers
- Preferred name
- Antineoplastic-12614
- IUPAC
- 3-amino-4-dichloroarsanylbenzoic acid;hydrochloride
Names & synonyms
5425-61-6ANTINEOPLASTIC-12614DTXSID80636467NSC12614NSC-126143-Amino-4-(dichloroarsanyl)benzoic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
5425-61-6- PubChem CID
- 24181925
- DTXSID
DTXSID80636467
Properties
Computed structural properties
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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