Basic information
- Standard SMILES
O=P(O)(O)C(c1ccccc1)P(=O)(O)O- InChIKey
FRLTXWJJMCIUNT-UHFFFAOYSA-N- Molecular formula
- C7H10O6P2
- Average molar mass
- 252.1 g/mol
- Monoisotopic mass
- 251.99526203
Names & identifiers
- Preferred name
- RU78783
- IUPAC
- [phenyl(phosphono)methyl]phosphonic acid
Names & synonyms
RU78783[phenyl(phosphono)methyl]phosphonic acid(phenyl(phosphono)methyl)phosphonic acidRefChem:883897(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID(phenylmethanediyl)bis(phosphonic acid)1o4rbenzylidenebisphosphonic acidCHEMBL148732phenyl methane diphosphonic acidSCHEMBL4094661BDBM14678
Show more names
FRLTXWJJMCIUNT-UHFFFAOYSA-NDB02908NS00068933Q27093890
Database identifiers
- PubChem CID
- 447537
- ChEMBL
CHEMBL148732- Nikkaji
- J2.801.126A
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 277
Related reactions
2 records
Compound notes
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