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Substance Name: Badische acid
RN: 86-60-2
UNII: 5X2OFI65RR
InChIKey: FYVOTMMSGKWFPK-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C10-H9-N-O3-S

Molecular Weight

  • 223.251
 
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Names and Synonyms

Name of Substance

  • Badische acid

Synonyms

  • 2-Naphthylamine-8-sulfonic acid
  • 4-14-00-02802 (Beilstein Handbook Reference)
  • 7-Amino-1-naphthalenesulfonic acid
  • Baden acid
  • Badische acid
  • BRN 2695330
  • EINECS 201-685-0
  • UNII-5X2OFI65RR

Systematic Names

  • 1-Naphthalenesulfonic acid, 7-amino-
  • 7-Aminonaphthalene-1-sulphonic acid

Registry Numbers

CAS Registry Number

  • 86-60-2

FDA UNII

  • 5X2OFI65RR

System Generated Number

  • 0000086602

Structure Descriptors

InChI

1S/C10H9NO3S/c11-8-5-4-7-2-1-3-10(9(7)6-8)15(12,13)14/h1-6H,11H2,(H,12,13,14)

InChIKey

FYVOTMMSGKWFPK-UHFFFAOYSA-N

Smiles

c12c(cccc1S(O)(=O)=O)ccc(c2)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.910 (none)   EST
Water Solubility 600 mg/L 20 EXP
Atmospheric OH Rate Constant 4.41E-11 cm3/molecule-sec 25 EST

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