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Substance Name: Diethyl carbonate
RN: 105-58-8
UNII: 3UA92692HG
InChIKey: OIFBSDVPJOWBCH-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect
  • Tumor Data

Molecular Formula

  • C5-H10-O3

Molecular Weight

  • 118.131
 
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Names and Synonyms

Name of Substance

  • Diethyl carbonate
  • Ethyl carbonate

Synonyms

  • AI3-00365
  • Carbonic acid diethyl ester
  • Carbonic ether
  • CCRIS 6229
  • Diaethylcarbonat
  • Diaethylcarbonat [German]
  • Diatol
  • Diethyl carbonate
  • Diethylester kyseliny uhlicite
  • Diethylester kyseliny uhlicite [Czech]
  • Diethylkarbonat
  • Diethylkarbonat [Czech]
  • EC 203-311-1
  • EINECS 203-311-1
  • Ethoxyformic anhydride
  • Ethyl carbonate
  • Ethyl carbonate ((EtO)2CO)
  • Eufin
  • HSDB 925
  • NCI-C60899
  • NSC 8849
  • UNII-3UA92692HG

Systematic Names

  • Carbonic acid, diethyl ester
  • Diethyl carbonate

Superlist Names

  • Carbonic acid, diethyl ester
  • Diethyl carbonate
  • Diethyl carbonate [UN2366] [Flammable liquid]
  • UN2366

Registry Numbers

CAS Registry Number

  • 105-58-8

FDA UNII

  • 3UA92692HG

System Generated Number

  • 0000105588

Structure Descriptors

InChI

1S/C5H10O3/c1-3-7-5(6)8-4-2/h3-4H2,1-2H3

InChIKey

OIFBSDVPJOWBCH-UHFFFAOYSA-N

Smiles

C(OCC)(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 subcutaneous 8500mg/kg (8500mg/kg)   Compilation of LD50 Values of New Drugs.
rat LDLo oral 15gm/kg (15000mg/kg)   FAO Nutrition Meetings Report Series. Vol. 53A, Pg. 52, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.30E+01 deg C   EXP
Boiling Point 126 deg C   EXP
log P (octanol-water) 1.21 (none)   EXP
Water Solubility 1.88E+04 mg/L 20 EXP
Vapor Pressure 10.8 mm Hg 25 EXP
Henry's Law Constant 8.93E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.32E-12 cm3/molecule-sec 25 EST

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