{4-[(4,6-Diamino-1,3,5-triazin-2-yl)amino]phenyl}arsonous acid
Basic information
- CAS
5425-22-9- Standard SMILES
Nc1nc(N)nc(Nc2ccc([As](O)O)cc2)n1- InChIKey
LISADAZIUYLPRW-UHFFFAOYSA-N- Molecular formula
- C9H11AsN6O2
- Average molar mass
- 310.14 g/mol
- Monoisotopic mass
- 310.015943
Names & identifiers
- Preferred name
- {4-[(4,6-Diamino-1,3,5-triazin-2-yl)amino]phenyl}arsonous acid
- IUPAC
- [4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]arsonous acid
- English name
- [4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]arsonous acid
- Molecular formula
- C9H11AsN6O2
- Molecular weight
- 310.14
Names & synonyms
5425-22-9{4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl}arsonous acidNSC12729ANTINEOPLASTIC-12729DTXSID60279457NSC-12729[4-[(4,6-diamino-1,3,5-triazin-2-yl)amino]phenyl]arsonous acidBenzenearsonous acid, p-[(4,6-diamino-s-triazin-2-yl)amino]- (8CI)
Database identifiers
- CAS
5425-22-9- PubChem CID
- 224348
- DTXSID
DTXSID60279457
Properties
Computed structural properties
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 253
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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