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1-Carboxyethenyl hydrogen phosphate

HCID 6315
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
73-89-2
Standard SMILES
C=C(OP(=O)([O-])O)C(=O)O
InChIKey
DTBNBXWJWCWCIK-UHFFFAOYSA-M
Molecular formula
C3H4O6P-
Average molar mass
167.03 g/mol
Monoisotopic mass
166.97454984

Overview

See also: 2-Propenoic acid, 2-(phosphonooxy)-, ion(1-) (preferred).

Names & identifiers

Preferred name
1-Carboxyethenyl hydrogen phosphate
IUPAC
1-carboxyethenyl hydrogen phosphate

Names & synonyms

1-carboxyethenyl hydrogen phosphate2-(Phosphonooxy)acrylic acidAG-670/32487025

Database identifiers

CAS
73-89-2
PubChem CID
6315

Properties

Computed structural properties

XLogP
-1.2
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
10
Formal charge
-1
Complexity
199

Related reactions

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Compound notes

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