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Substance Name: Propanedioic acid, 2-((4-methoxyphenyl)methylene)-, 1,3-diethyl ester
RN: 6768-23-6
InChIKey: KUBLMWHFTKNBHL-UHFFFAOYSA-N

Molecular Formula

  • C15-H18-O5

Molecular Weight

  • 278.302
 
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Names and Synonyms

Synonyms

  • EINECS 229-827-7
  • NSC 95160
  • para-Methoxybenzylidenemalonic acid, diethyl ester

Systematic Names

  • Diethyl (p-methoxybenzylidene)malonate
  • Propanedioic acid, ((4-methoxyphenyl)methylene)-, diethyl ester
  • Propanedioic acid, 2-((4-methoxyphenyl)methylene)-, 1,3-diethyl ester

Registry Numbers

CAS Registry Number

  • 6768-23-6

System Generated Number

  • 0006768236

Structure Descriptors

InChI

1S/C15H18O5/c1-4-19-14(16)13(15(17)20-5-2)10-11-6-8-12(18-3)9-7-11/h6-10H,4-5H2,1-3H3

InChIKey

KUBLMWHFTKNBHL-UHFFFAOYSA-N

Smiles

c1cc(OC)ccc1\C=C(\C(=O)OCC)C(=O)OCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.28 (none)   EXP
Water Solubility 25.9 mg/L 25 EST
Vapor Pressure 2.43E-04 mm Hg 25 EST
Henry's Law Constant 6.47E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.50E-11 cm3/molecule-sec 25 EST

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