1-Carboxyvinyl carboxyphosphonate
Basic information
- CAS
122723-92-6- Standard SMILES
C=C(OP(=O)(O)C(=O)O)C(=O)O- InChIKey
LPUFGTSGSICQBX-UHFFFAOYSA-N- Molecular formula
- C4H5O7P
- Average molar mass
- 196.05 g/mol
- Monoisotopic mass
- 195.97728949
Overview
1-carboxyvinyl carboxyphosphonate is an organic phosphonate having O-1-carboxyvinyl and C-carboxy substituents. It is an organic phosphonate and a phosphonic ester. It is a conjugate acid of a 1-carboxylatovinyl carboxylatophosphonate(3-).
Names & identifiers
- Preferred name
- 1-Carboxyvinyl carboxyphosphonate
- IUPAC
- 2-[carboxy(hydroxy)phosphoryl]oxyprop-2-enoic acid
Names & synonyms
1-Carboxyvinyl carboxyphosphonateCarboxyphosphonoenolpyruvate2-[carboxy(hydroxy)phosphoryl]oxyprop-2-enoic acid1-carboxyethenyl hydrogen carboxyphosphonateCHEBI:170562-(carboxy(hydroxy)phosphoryl)oxyprop-2-enoic acidRefChem:753012-(Carboxy-hydroxy-phosphoryl)oxyprop-2-enoic acid122723-92-6C06367orb3179909DTXSID301384022
Show more names
2-[[Carboxy(hydroxy)phosphoryl]oxy]prop-2-enoic acidQ27102190
Database identifiers
- CAS
122723-92-6- PubChem CID
- 360637
- DTXSID
DTXSID301384022- ChEBI
CHEBI:17056- Nikkaji
- J365.814G
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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