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Substance Name: Sulfoacetic acid
RN: 123-43-3
UNII: Y4XC05H603
InChIKey: AGGIJOLULBJGTQ-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C2-H4-O5-S

Molecular Weight

  • 140.115
 
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Names and Synonyms

Name of Substance

  • Sulfoacetic acid

Synonyms

  • 4-04-00-00102 (Beilstein Handbook Reference)
  • Acetic acid, sulfo-
  • AI3-28536
  • BRN 1764390
  • EINECS 204-627-2
  • HSDB 2706
  • Kyselina sulfooctova
  • Kyselina sulfooctova [Czech]
  • Sulfoacetic acid
  • Sulfoethanoic acid
  • UNII-Y4XC05H603

Systematic Names

  • Acetic acid, 2-sulfo-
  • Acetic acid, sulfo-
  • Sulphoacetic acid

Registry Numbers

CAS Registry Number

  • 123-43-3

FDA UNII

  • Y4XC05H603

Other Registry Number

  • 44656-61-3

System Generated Number

  • 0000123433

Structure Descriptors

InChI

1S/C2H4O5S/c3-2(4)1-8(5,6)7/h1H2,(H,3,4)(H,5,6,7)

InChIKey

AGGIJOLULBJGTQ-UHFFFAOYSA-N

Smiles

S(CC(O)=O)(O)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 1570mg/kg (1570mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 31, Pg. 60, 1949.
rat LD50 oral 3160mg/kg (3160mg/kg)   Journal of Industrial Hygiene and Toxicology. Vol. 31, Pg. 60, 1949.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 85 deg C   EXP
log P (octanol-water) -0.880 (none)   EST
Atmospheric OH Rate Constant 1.36E-12 cm3/molecule-sec 25 EST

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