Thiazole, 5-(3-chloropropyl)-4-methyl-, 1,2-ethanedisulfonate structure

Thiazole, 5-(3-chloropropyl)-4-methyl-, 1,2-ethanedisulfonate

5-(3-chloropropyl)-4-methyl-1,3-thiazole;ethane-1,2-disulfonic acid

Also Known As: Thiazole, 5-(3-chloropropyl)-4-methyl-, 1,2-ethanedisulfonate|5-(3-Chloropropyl)-4-methylthiazole 1,2-ethanedisulfonate|Ethanedisulfonate-1,2 de methyl-4 gamma-chloropropyl-5 thiazole [French]|Ethanedisulfonate-1,2 de methyl-4 gamma-chloropropyl-5 thiazole|1,2-Ethanedisulfonic acid, compd. with 5-(3-chloropropyl)-4-methylthiazole|5-(3-chloropropyl)-4-methyl-1,3-thiazole; ethane-1,2-disulfonic acid|Ethane-1,2-disulfonic acid--5-(3-chloropropyl)-4-methyl-1,3-thiazole (1/1)

CAS: 6617-01-2
Molecular Formula C9H16ClNO6S3
Molecular Weight 364.98282 g/mol
LogP 1.38492
Topological Polar Surface Area 167.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 364.98282
Monoisotopic Mass 364.98282
Heavy Atoms 20
Complexity 338.0

Chemical Identifiers

CAS Number 6617-01-2
SMILES CC1=C(SC=N1)CCCCl.C(CS(=O)(=O)O)S(=O)(=O)O
InChIKey MBDIQCAEPLUTMF-UHFFFAOYSA-N

Product Overview

Thiazole, 5-(3-chloropropyl)-4-methyl-, 1,2-ethanedisulfonate (CAS 6617-01-2), with molecular formula C9H16ClNO6S3 and molecular weight 364.98282 g/mol. IUPAC: 5-(3-chloropropyl)-4-methyl-1,3-thiazole;ethane-1,2-disulfonic acid.

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