benzothiazolium, 5,6-dimethoxy-2-methyl-3-(3-sulfopropyl)-, inner salt

Name: benzothiazolium, 5,6-dimethoxy-2-methyl-3-(3-sulfopropyl)-, inner salt
Brand: CoreyChem
SKU: CAS:63148-95-8
Price: Contact for pricing USD
Availability: InStock

3-(5,6-dimethoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate

Also Known As: 3-(5,6-dimethoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate|Benzothiazolium, 5,6-dimethoxy-2-methyl-3-(3-sulfopropyl)-, inner salt|5,6-Dimethoxy-2-methyl-3-(3-sulfonatopropyl)benzothiazol-3-ium|3-(5,6-dimethoxy-2-methylbenzothiazol-3-yl)propanesulfonic acid|5,6-DIMETHOXY-2-METHYL-3-(3-SULFONATOPROPYL)-1,3-BENZOTHIAZOL-3-IUM|Benzothiazolium, 5,6-dimethoxy-2-methyl-3-(3-sulfopropyl)-, hydroxide, inner salt

CAS: 63148-95-8

Molecular Formula	`C13H17NO5S2`
Molecular Weight	331.0548 g/mol
LogP	1.45
Topological Polar Surface Area	79.54 Å²
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	331.0548
Heavy Atoms	21
Complexity	751.5

Chemical Identifiers

CAS Number	63148-95-8
SMILES	`CC1=[N+](C2=CC(=C(C=C2S1)OC)OC)CCCS(=O)(=O)[O-]`

Product Overview

benzothiazolium, 5,6-dimethoxy-2-methyl-3-(3-sulfopropyl)-, inner salt (CAS 63148-95-8), with molecular formula C13H17NO5S2 and molecular weight 331.0548 g/mol. IUPAC: 3-(5,6-dimethoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate.

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