1,2-Benzisothiazole-2(3H)-pentanoic acid, 3-oxo-, 1,1-dioxide

CAS Registry Number®

83747-22-2

CAS Name

1,2-Benzisothiazole-2(3H)-pentanoic acid, 3-oxo-, 1,1-dioxide

Molecular Formula

C12H13NO5S

Molecular Mass

283.30

Cite this Page

1,2-Benzisothiazole-2(3H)-pentanoic acid, 3-oxo-, 1,1-dioxide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83747-22-2 (retrieved 2024-11-23) (CAS RN: 83747-22-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H13NO5S/c14-11(15)7-3-4-8-13-12(16)9-5-1-2-6-10(9)19(13,17)18/h1-2,5-6H,3-4,7-8H2,(H,14,15)

InChIKey

InChIKey=GPGHRDSNAKAXQP-UHFFFAOYSA-N

SMILES

O=C1C=2C(S(=O)(=O)N1CCCCC(O)=O)=CC=CC2

Canonical SMILES

O=C(O)CCCCN1C(=O)C=2C=CC=CC2S1(=O)=O

Other Names for this Substance

  • 1,2-Benzisothiazole-2(3H)-pentanoic acid, 3-oxo-, 1,1-dioxide
  • 5-(1,1-Dioxido-3-oxobenzo[d]isothiazol-2-yl)-pentanoic acid

CAS INSIGHTSTM
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