Phosphonic acid, (p-((2,4,6-triamino-5-pyrimidinyl)azo)phenyl)-
Basic information
- CAS
3822-79-5- Standard SMILES
Nc1nc(N)c(N=Nc2ccc(P(=O)(O)O)cc2)c(N)n1- InChIKey
JYPHIJBAOKJHOJ-UHFFFAOYSA-N- Molecular formula
- C10H12N7O3P
- Average molar mass
- 309.22 g/mol
- Monoisotopic mass
- 309.07392427
Names & identifiers
- Preferred name
- Phosphonic acid, (p-((2,4,6-triamino-5-pyrimidinyl)azo)phenyl)-
- IUPAC
- [4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]phenyl]phosphonic acid
Names & synonyms
PY-803822-79-5NSC 520867BRN 0329539Phosphonic acid, (p-((2,4,6-triamino-5-pyrimidinyl)azo)phenyl)-(p-((2,4,6-Triamino-5-pyrimidinyl)azo)phenyl)phosphonic acid5-25-18-00290 (Beilstein Handbook Reference)Phosphonic acid, [p-[(2,4,6-triamino-5-pyrimidinyl)azo]phenyl]-RefChem:370540NSC-520867[4-[(2,4,6-triaminopyrimidin-5-yl)diazenyl]phenyl]phosphonic acid{4-[(2,4,6-Triaminopyrimidin-5-yl)diazenyl]phenyl}phosphonic acid
Show more names
NSC5208672XQ8N9K4M3SCHEMBL30219651DTXSID101173398
Database identifiers
- CAS
3822-79-5- PubChem CID
- 101443
- DTXSID
DTXSID101173398- UNII
- 2XQ8N9K4M3
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 186 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 411
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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