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Substance Name: Dimethyl glutarate
RN: 1119-40-0
UNII: 1I9VFA346P
InChIKey: XTDYIOOONNVFMA-UHFFFAOYSA-N

Molecular Formula

  • C7-H12-O4

Molecular Weight

  • 160.1678
 
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Names and Synonyms

Name of Substance

  • Dimethyl glutarate
  • Dimethyl pentanedioate
  • Pentanedioic acid, dimethyl ester

Synonyms

  • AI3-06026
  • DBE 5
  • Dimethyl glutarate
  • Dimethyl pentanedioate
  • EC 214-277-2
  • EINECS 214-277-2
  • Glutaric acid, dimethyl ester
  • HSDB 5789
  • NSC 58578
  • Pentanedioic acid, dimethyl ester
  • UNII-1I9VFA346P

Systematic Names

  • Dimethyl glutarate
  • Glutaric acid, dimethyl ester (8CI)
  • Pentanedioic acid, 1,5-dimethyl ester
  • Pentanedioic acid, dimethyl ester

Superlist Names

  • Dimethyl glutarate
  • Glutaric acid, dimethyl ester

Registry Numbers

CAS Registry Number

  • 1119-40-0

FDA UNII

  • 1I9VFA346P

Other Registry Number

  • 111366-62-2

System Generated Number

  • 0001119400

Structure Descriptors

InChI

1S/C7H12O4/c1-10-6(8)4-3-5-7(9)11-2/h3-5H2,1-2H3

InChIKey

XTDYIOOONNVFMA-UHFFFAOYSA-N

Smiles

C(=O)(CCCC(=O)OC)OC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -4.25E+01 deg C   EXP
Boiling Point 214 deg C   EXP
log P (octanol-water) 0.62 (none)   EXP
Water Solubility 5.90E+04 mg/L 25 EXP
Henry's Law Constant 6.43E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.30E-12 cm3/molecule-sec 25 EXP

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