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Substance Name: Ethyl orotate
RN: 1747-53-1
UNII: 5IE748TQOR
InChIKey: OQIITSDYUWKGGR-UHFFFAOYSA-N

Molecular Weight

  • 184.1502
 
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Names and Synonyms

Name of Substance

  • Ethyl orotate

Synonyms

  • 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, ethyl ester
  • Orotic acid ethyl ester
  • Orotic acid ethyl ester [MI]
  • Orotic acid, ethyl ester
  • UNII-5IE748TQOR
  • YM-39558

Registry Numbers

CAS Registry Number

  • 1747-53-1

FDA UNII

  • 5IE748TQOR

System Generated Number

  • 0001747531

Structure Descriptors

InChI

1S/C7H8N2O4/c1-2-13-6(11)4-3-5(10)9-7(12)8-4/h3H,2H2,1H3,(H2,8,9,10,12)

InChIKey

OQIITSDYUWKGGR-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=CC(=O)NC(=O)N1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.68 (none)   EXP
Water Solubility 1.38E+04 mg/L 25 EST
Vapor Pressure 4.56E-08 mm Hg 25 EST
Henry's Law Constant 3.44E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.00E-11 cm3/molecule-sec 25 EST

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