3-(4-Methyl-2-nitrophenoxy)-1-propanesulfonic acid

CAS Registry Number®

79817-53-1

CAS Name

3-(4-Methyl-2-nitrophenoxy)-1-propanesulfonic acid

Molecular Formula

C10H13NO6S

Molecular Mass

275.28

Cite this Page

3-(4-Methyl-2-nitrophenoxy)-1-propanesulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79817-53-1 (retrieved 2024-11-30) (CAS RN: 79817-53-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H13NO6S/c1-8-3-4-10(9(7-8)11(12)13)17-5-2-6-18(14,15)16/h3-4,7H,2,5-6H2,1H3,(H,14,15,16)

InChIKey

InChIKey=USOXFCZQOCMJEH-UHFFFAOYSA-N

SMILES

O(CCCS(=O)(=O)O)C1=C(N(=O)=O)C=C(C)C=C1

Canonical SMILES

O=N(=O)C1=CC(=CC=C1OCCCS(=O)(=O)O)C

Other Names for this Substance

  • 1-Propanesulfonic acid, 3-(4-methyl-2-nitrophenoxy)-
  • 3-(4-Methyl-2-nitrophenoxy)-1-propanesulfonic acid

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