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Substance Name: 2-Furoic acid
RN: 88-14-2
UNII: P577F6494A
InChIKey: SMNDYUVBFMFKNZ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C5-H4-O3

Molecular Weight

  • 112.084
 
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Names and Synonyms

Name of Substance

  • 2-Furoic acid

Synonyms

  • 2-Carboxyfuran
  • 2-Furoic acid
  • 5-18-06-00102 (Beilstein Handbook Reference)
  • AI3-16500
  • alpha-Furancarboxylic acid
  • alpha-Furoic acid
  • BRN 0110149
  • CCRIS 2157
  • EINECS 201-803-0
  • Kyselina 2-furoova
  • Kyselina 2-furoova [Czech]
  • Kyselina pyroslizova
  • Kyselina pyroslizova [Czech]
  • NSC 8842
  • Pyromucic acid
  • UNII-P577F6494A

Systematic Names

  • 2-Furancarboxylic acid
  • 2-Furoic acid

Registry Numbers

CAS Registry Number

  • 88-14-2

FDA UNII

  • P577F6494A

System Generated Number

  • 0000088142

Structure Descriptors

InChI

1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

InChIKey

SMNDYUVBFMFKNZ-UHFFFAOYSA-N

Smiles

c1(C(O)=O)ccco1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Pharmaceutical Research. Vol. 2, Pg. 233, 1985.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 133.5 deg C   EXP
Boiling Point 231 deg C   EXP
log P (octanol-water) 0.64 (none)   EXP
Water Solubility 3.71E+04 mg/L 15 EXP
Vapor Pressure 0.103 mm Hg 25 EST
Henry's Law Constant 1.08E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.55E-11 cm3/molecule-sec 25 EST

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