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Substance Name: Ethylene glycol monobenzoate
RN: 94-33-7
UNII: 6172C054XY
InChIKey: LSWRBVSEWBWTDR-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-O3

Molecular Weight

  • 166.175
 
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Names and Synonyms

Name of Substance

  • Ethylene glycol monobenzoate

Synonyms

  • 2-(Benzoyloxy)ethanol
  • 2-Hydroxyethyl benzoate
  • AI3-06584
  • beta-Hydroxyethyl benzoate
  • EINECS 202-323-4
  • Ethylene glycol monobenzoate
  • Ethyleneglycol monobenzoate
  • NSC 57378
  • UNII-6172C054XY

Systematic Names

  • 1,2-Ethanediol, 1-benzoate
  • 1,2-Ethanediol, monobenzoate
  • 2-Hydroxyethyl benzoate
  • Ethylene glycol, monobenzoate (8CI)

Registry Numbers

CAS Registry Number

  • 94-33-7

FDA UNII

  • 6172C054XY

System Generated Number

  • 0000094337

Structure Descriptors

InChI

1S/C9H10O3/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5,10H,6-7H2

InChIKey

LSWRBVSEWBWTDR-UHFFFAOYSA-N

Smiles

O=C(OCCO)c1ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 45 deg C   EXP
log P (octanol-water) 1.12 (none)   EXP
Water Solubility 2.29E+04 mg/L 25 EST
Vapor Pressure 2.71E-04 mm Hg 25 EST
Henry's Law Constant 1.68E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.63E-12 cm3/molecule-sec 25 EST

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