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Substance Name: alpha-Nitro-2-furanacrylic acid, methyl ester
RN: 72999-11-2
InChIKey: ZUEPECDFMFZCNG-ALCCZGGFSA-N

Molecular Weight

  • 197.145
 
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Names and Synonyms

Synonyms

  • 3-(2-Furyl)-2-nitropropenoic acid, methyl ester
  • CCRIS 5655

Systematic Name

  • alpha-Nitro-2-furanacrylic acid, methyl ester

Registry Numbers

CAS Registry Number

  • 72999-11-2

System Generated Number

  • 0072999112

Structure Descriptors

InChI

1S/C8H7NO5/c1-13-8(10)7(9(11)12)5-6-3-2-4-14-6/h2-5H,1H3/b7-5-

InChIKey

ZUEPECDFMFZCNG-ALCCZGGFSA-N

Smiles

C(\[N+]([O-])=O)(=C/c1occc1)C(OC)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.88 (none)   EXP
Water Solubility 457 mg/L 25 EST
Vapor Pressure 1.21E-03 mm Hg 25 EST
Henry's Law Constant 5.20E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.45E-11 cm3/molecule-sec 25 EST

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