Basic information
- CAS
1177522-29-0- Standard SMILES
O=C(O)/C(=C\OP(=O)(O)O)c1ccccc1- InChIKey
BFEFHIYTKUTNCG-VURMDHGXSA-N- Molecular formula
- C9H9O6P
- Average molar mass
- 244.14 g/mol
- Monoisotopic mass
- 244.013675
Names & identifiers
- Preferred name
- (2Z)-2-Phenyl-3-(phosphonooxy)prop-2-enoic acid
- IUPAC
- (Z)-2-phenyl-3-phosphonooxyprop-2-enoic acid
Names & synonyms
(2Z)-2-Phenyl-3-(phosphonooxy)prop-2-enoic acidDTXSID1010098761177522-29-0CP5
Database identifiers
- CAS
1177522-29-0- PubChem CID
- 448552
- DTXSID
DTXSID101009876
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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