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CHEBI:1159 - 2-hydroxyethylphosphonic acid

Default Structure
ChEBI IDCHEBI:1159
ChEBI Name2-hydroxyethylphosphonic acid
Stars
DefinitionA phosphonic acid consisting of ethanol with the phospho group at the 2-position.
Last Modified28 July 2014
DownloadsMolfile
FormulaC2H7O4P
Net Charge0
Average Mass126.048
Monoisotopic Mass126.00820
SMILESO=P(O)(O)CCO
InChIInChI=1S/C2H7O4P/c3-1-2-7(4,5)6/h3H,1-2H2,(H2,4,5,6)
InChIKeySEHJHHHUIGULEI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-hydroxyethylphosphonic acid (CHEBI:1159) has functional parent phosphonic acid (CHEBI:44976)
2-hydroxyethylphosphonic acid (CHEBI:1159) is a phosphonic acids (CHEBI:26069)
2-hydroxyethylphosphonic acid (CHEBI:1159) is conjugate acid of 2-hydroxyethylphosphonic acid(1−) (CHEBI:60991)
Incoming Relation(s)
2-hydroxyethylphosphonic acid(1−) (CHEBI:60991) is conjugate base of 2-hydroxyethylphosphonic acid (CHEBI:1159)
IUPAC Name 
(2-hydroxyethyl)phosphonic acid
Synonyms  Source
2-hydroxyethanephosphonic acidChemIDplus
2-HydroxyethylphosphonateKEGG COMPOUND
Manual XrefsDatabases
2HEPDBeChem
C00000916KNApSAcK
C06451KEGG COMPOUND
Registry NumbersSources
Reaxys:1751212Reaxys
CAS:22987-21-9ChemIDplus