2-Amino-5-(2-sulfatoethylsulfonyl)benzenesulfonic acid

CAS Registry Number®

42986-22-1
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CAS Name

2-Amino-5-(2-sulfatoethylsulfonyl)benzenesulfonic acid

Molecular Formula

C8H11NO9S3

Molecular Mass

361.37

Cite this Page

2-Amino-5-(2-sulfatoethylsulfonyl)benzenesulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42986-22-1 (retrieved 2024-07-06) (CAS RN: 42986-22-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H11NO9S3/c9-7-2-1-6(5-8(7)20(12,13)14)19(10,11)4-3-18-21(15,16)17/h1-2,5H,3-4,9H2,(H,12,13,14)(H,15,16,17)

InChIKey

InChIKey=UQEAQYXIDTYYNI-UHFFFAOYSA-N

SMILES

S(CCOS(=O)(=O)O)(=O)(=O)C1=CC(S(=O)(=O)O)=C(N)C=C1

Canonical SMILES

O=S(=O)(O)OCCS(=O)(=O)C1=CC=C(N)C(=C1)S(=O)(=O)O

Other Names for this Substance

  • Benzenesulfonic acid, 2-amino-5-[[2-(sulfooxy)ethyl]sulfonyl]-
  • 2-Amino-5-[[2-(sulfooxy)ethyl]sulfonyl]benzenesulfonic acid
  • 4-Amino-3-sulfophenyl 2-sulfatoethyl sulfone
  • 2-Amino-5-(β-sulfatoethylsulfonyl)benzenesulfonic acid
  • 4-(β-Sulfatoethylsulfonyl)-2-sulfoaniline

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