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Substance Name: 2-Amino-4-sulfobenzoic acid
RN: 98-43-1
UNII: 87T8B9176E
InChIKey: GRGSHONWRKRWGP-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-N-O5-S

Molecular Weight

  • 217.2
 
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Names and Synonyms

Name of Substance

  • 2-Amino-4-sulfobenzoic acid

Synonyms

  • EC 202-668-0
  • EINECS 202-668-0
  • UNII-87T8B9176E

Systematic Names

  • 4-Sulphoanthranilic acid
  • Benzoic acid, 2-amino-4-sulfo-

Registry Numbers

CAS Registry Number

  • 98-43-1

FDA UNII

  • 87T8B9176E

System Generated Number

  • 0000098431

Structure Descriptors

InChI

1S/C7H7NO5S/c8-6-3-4(14(11,12)13)1-2-5(6)7(9)10/h1-3H,8H2,(H,9,10)(H,11,12,13)

InChIKey

GRGSHONWRKRWGP-UHFFFAOYSA-N

Smiles

O=C(O)c1c(N)cc(S(=O)(=O)O)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -1.800 (none)   EST
Water Solubility 1.05E+04 mg/L 25 EXP
Atmospheric OH Rate Constant 9.18E-12 cm3/molecule-sec 25 EST

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