p-(Dihydroxyarsino)-hippuric acid
Basic information
- CAS
5425-20-7- Standard SMILES
O=C(O)CNC(=O)c1ccc([As](O)O)cc1- InChIKey
BNKTYOFKGZZYHM-UHFFFAOYSA-N- Molecular formula
- C9H10AsNO5
- Average molar mass
- 287.1 g/mol
- Monoisotopic mass
- 286.977492
Names & identifiers
- Preferred name
- p-(Dihydroxyarsino)-hippuric acid
- IUPAC
- 2-[(4-dihydroxyarsanylbenzoyl)amino]acetic acid
Names & synonyms
5425-20-7HIPPURIC ACID, p-(DIHYDROXYARSINO)-PJT4TD490Op-(Dihydroxyarsino)-hippuric acidNSC-12726DTXSID80202601RefChem:1094142DTXCID70125092p-(Dihydroxyarsino)hippuric acidNSC 12726UNII-PJT4TD490OANTINEOPLASTIC-12726
Show more names
NSC12726N-[4-(Dihydroxyarsanyl)benzoyl]glycine
Database identifiers
- CAS
5425-20-7- PubChem CID
- 21544
- DTXSID
DTXSID80202601- UNII
- PJT4TD490O
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 263
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Compound notes
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