3H-1,2,3-Benzoxathiazole-3-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aR,7aS)-

CAS Registry Number®

1206227-47-5
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CAS Name

3H-1,2,3-Benzoxathiazole-3-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aR,7aS)-

Molecular Formula

C11H19NO5S

Molecular Mass

277.34

Cite this Page

3H-1,2,3-Benzoxathiazole-3-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aR,7aS)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1206227-47-5 (retrieved 2024-08-09) (CAS RN: 1206227-47-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    126.9-127.6 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H19NO5S/c1-11(2,3)16-10(13)12-8-6-4-5-7-9(8)17-18(12,14)15/h8-9H,4-7H2,1-3H3/t8-,9+/m1/s1

InChIKey

InChIKey=QTTRZKVOSCVFJO-BDAKNGLRSA-N

SMILES

C(OC(C)(C)C)(=O)N1[C@]2([C@@](OS1(=O)=O)(CCCC2)[H])[H]

Canonical SMILES

O=C(OC(C)(C)C)N1C2CCCCC2OS1(=O)=O

Other Names for this Substance

  • 3H-1,2,3-Benzoxathiazole-3-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, 2,2-dioxide, (3aR,7aS)-