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Substance Name: Ethyl 3-hydroxybutyrate
RN: 5405-41-4
UNII: 52008C87PV
InChIKey: OMSUIQOIVADKIM-UHFFFAOYSA-N

Molecular Formula

  • C6-H12-O3

Molecular Weight

  • 132.1578
 
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Names and Synonyms

Name of Substance

  • Ethyl 3-hydroxybutyrate

Synonyms

  • AI3-11592
  • Butanoic acid, 3-hydroxy-, ethyl ester
  • Butyric acid, 3-hydroxy-, ethyl ester
  • EINECS 226-456-2
  • EINECS 252-642-8
  • Ethyl 3-hydroxybutanoate
  • Ethyl 3-hydroxybutyrate
  • Ethyl 3-hydroxybutyrate (natural)
  • Ethyl beta-hydroxybutyrate
  • FEMA No. 3428
  • NSC 42916
  • NSC 8115
  • UNII-52008C87PV

Systematic Names

  • Butanoic acid, 3-hydroxy-, ethyl ester
  • Ethyl (1)-3-hydroxybutyrate
  • Ethyl 3-hydroxybutyrate

Superlist Name

  • Ethyl 3-hydroxybutyrate

Registry Numbers

CAS Registry Number

  • 5405-41-4

FDA UNII

  • 52008C87PV

Other Registry Number

  • 35608-64-1

System Generated Number

  • 0005405414

Structure Descriptors

InChI

1S/C6H12O3/c1-3-9-6(8)4-5(2)7/h5,7H,3-4H2,1-2H3

InChIKey

OMSUIQOIVADKIM-UHFFFAOYSA-N

Smiles

CCOC(=O)CC(C)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 185 deg C   EXP
log P (octanol-water) 0.310 (none)   EST
Atmospheric OH Rate Constant 1.07E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.