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Substance Name: Dihydroxyfumarate
RN: 133-38-0
InChIKey: BZCOSCNPHJNQBP-OWOJBTEDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C4-H4-O6

Molecular Weight

  • 148.07
 
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Names and Synonyms

Name of Substance

  • Dihydroxyfumarate

Synonyms

  • (E)-2,3-Dihydroxy-2-butenedioic acid
  • 4-03-00-01975 (Beilstein Handbook Reference)
  • Acido diidrossifumarico
  • Acido diidrossifumarico [Italian]
  • BRN 1724790
  • Dihydroxyfumarate
  • Dihydroxyfumaric acid
  • EINECS 205-106-2
  • NSC 20941
  • RTECS LX5712000

Systematic Names

  • 2,3-Dihydroxyfumaric acid
  • 2-Butenedioic acid, 2,3-dihydroxy-, (2E)-
  • 2-Butenedioic acid, 2,3-dihydroxy-, (E)- (9CI)
  • Fumaric acid, dihydroxy-

Registry Numbers

CAS Registry Number

  • 133-38-0

System Generated Number

  • 0000133380

Structure Descriptors

InChI

1S/C4H4O6/c5-1(3(7)8)2(6)4(9)10/h5-6H,(H,7,8)(H,9,10)/b2-1+

InChIKey

BZCOSCNPHJNQBP-OWOJBTEDSA-N

Smiles

C(=C(\C(O)=O)O)(\C(O)=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 6gm/kg (6000mg/kg)   Bollettino Chimico Farmaceutico. Vol. 101, Pg. 903, 1962.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.690 (none)   EST
Water Solubility 2960 mg/L 12 EXP
Atmospheric OH Rate Constant 1.48E-11 cm3/molecule-sec 25 EST

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