1,2-Benzisothiazole-2(3H)-acetic acid, 3-oxo-, 1-methylethyl ester, 1,1-dioxide
CAS Registry Number®
76508-37-7
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CAS Name
1,2-Benzisothiazole-2(3H)-acetic acid, 3-oxo-, 1-methylethyl ester, 1,1-dioxideMolecular Formula
C12H13NO5SMolecular Mass
283.30Cite this Page
1,2-Benzisothiazole-2(3H)-acetic acid, 3-oxo-, 1-methylethyl ester, 1,1-dioxide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=76508-37-7 (retrieved ) (CAS RN: 76508-37-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
118-119 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C12H13NO5S/c1-8(2)18-11(14)7-13-12(15)9-5-3-4-6-10(9)19(13,16)17/h3-6,8H,7H2,1-2H3
InChIKey
InChIKey=FULJHFVTOIYTGS-UHFFFAOYSA-N
SMILES
O=S1(=O)C=2C(C(=O)N1CC(OC(C)C)=O)=CC=CC2
Canonical SMILES
O=C(OC(C)C)CN1C(=O)C=2C=CC=CC2S1(=O)=O
Other Names for this Substance
- 1,2-Benzisothiazole-2(3H)-acetic acid, 3-oxo-, 1-methylethyl ester, 1,1-dioxide
