benzothiazolium, 2-methyl-3-(4-sulfobutyl)-, inner salt

Name: benzothiazolium, 2-methyl-3-(4-sulfobutyl)-, inner salt
Brand: CoreyChem
SKU: CAS:55526-95-9
Price: Contact for pricing USD
Availability: InStock

4-(2-methyl-1,3-benzothiazol-3-ium-3-yl)butane-1-sulfonate

Also Known As: EINECS 259-698-2|2-methyl-3- benzothiazolium|(?)-Butaclamol hydrochloride|LCZC1410|Benzothiazolium, 2-methyl-3-(4-sulfobutyl)-, inner salt|BAS 00482282|2-Methyl-3-(4-sulphonatobutyl)benzothiazolium|4-(2-methyl-1,3-benzothiazol-3-ium-3-yl)butane-1-sulfonate|2-Methyl-3-(4-sulfobutyl)benzothiazolium betaine|2-Methyl-3-(4-sulfonatobutyl)benzothiazol-3-ium|Benzothiazolium, 2-methyl-3-(4-sulfobutyl)-, hydroxide, inner salt|4-(2-methylbenzo[d]thiazol-3-ium-3-yl)butane-1-sulfonate|4-[(2-Methylbenzothiazole-3-ium)-3-yl]butane-1-sulfonate|2-METHYL-3-(4-SULFONATOBUTYL)-1,3-BENZOTHIAZOL-3-IUM

CAS: 55526-95-9

Molecular Formula	`C12H15NO3S2`
Molecular Weight	285.04935 g/mol
LogP	1.82
Topological Polar Surface Area	61.08 Å²
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	285.04935
Heavy Atoms	18
Complexity	646.4

Chemical Identifiers

CAS Number	55526-95-9
SMILES	`CC1=[N+](C2=CC=CC=C2S1)CCCCS(=O)(=O)[O-]`

Product Overview

benzothiazolium, 2-methyl-3-(4-sulfobutyl)-, inner salt (CAS 55526-95-9), with molecular formula C12H15NO3S2 and molecular weight 285.04935 g/mol. IUPAC: 4-(2-methyl-1,3-benzothiazol-3-ium-3-yl)butane-1-sulfonate.

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