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Substance Name: Diethoxymethane
RN: 462-95-3
UNII: 56IT408V5Y
InChIKey: KLKFAASOGCDTDT-UHFFFAOYSA-N

Molecular Formula

  • C5-H12-O2

Molecular Weight

  • 104.148
 
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Names and Synonyms

Name of Substance

  • Diethoxymethane

Synonyms

  • 1,1-Diethoxymethane
  • 3,5-Dioxaheptene
  • 4-01-00-03027 (Beilstein Handbook Reference)
  • AI3-24286
  • BRN 1697253
  • CCRIS 6891
  • Diethoxymethane
  • Diethylformal
  • EC 207-330-6
  • EINECS 207-330-6
  • Ethoxymethyl ethyl ether
  • Ethylal
  • Formaldehyde diethyl acetal
  • NSC 6754
  • UNII-56IT408V5Y

Systematic Names

  • Diethoxymethane
  • Ethane, 1,1'-(methylenebis(oxy))bis-
  • Methane, diethoxy-

Superlist Names

  • Diethoxymethane [UN2373] [Flammable liquid]
  • UN2373

Registry Numbers

CAS Registry Number

  • 462-95-3

FDA UNII

  • 56IT408V5Y

System Generated Number

  • 0000462953

Structure Descriptors

InChI

1S/C5H12O2/c1-3-6-5-7-4-2/h3-5H2,1-2H3

InChIKey

KLKFAASOGCDTDT-UHFFFAOYSA-N

Smiles

C(OCC)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 oral 2604mg/kg (2604mg/kg)   Proceedings of the Society for Experimental Biology and Medicine. Vol. 29, Pg. 730, 1932.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -6.65E+01 deg C   EXP
Boiling Point 88 deg C   EXP
log P (octanol-water) 0.84 (none)   EXP
Water Solubility 7.00E+04 mg/L 18 EXP
Vapor Pressure 34.1 mm Hg 25 EXP
Henry's Law Constant 6.68E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.68E-11 cm3/molecule-sec 25 EXP

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