2-[3-(3-Ethyl-3H-benzothiazol-2-ylidene)-2-methylprop-1-enyl]-3-(3-sulfonatobutyl)benzothiazolium

CAS

34935-38-1

Catalog Number

ACM34935381

Category

Other Products

Molecular Weight

486.669840 [g/mol]

Molecular Formula

C₂₄H₂₆N₂O₃S₃

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 252-296-8, CID6438072, 2-(3-(3-Ethyl-3H-benzothiazol-2-ylidene)-2-methylprop-1-enyl)-3-(3-sulphonatobutyl)benzothiazolium, 28789-08-4, 34935-38-1, Benzothiazolium, 2-(3-(3-ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propen-1-yl)-3-(3-sulfobutyl)-, inner salt, Benzothiazolium, 2-(3-(3-ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl)-3-(3-sulfobutyl)-, inner salt

IUPAC Name

4-[2-[(E,3E)-3-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methylprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]butane-2-sulfonate

Canonical SMILES

CC[N+]1=C(SC2=CC=CC=C21)C=C(C)C=C3[NH+](C4=CC=CC=C4S3)CCC(C)S(=O)(=O)[O-]

InChI Key

HHGWLRNRKVHQRS-UHFFFAOYSA-N

EC Number

252-296-8

Exact Mass

486.11100

H-Bond Acceptor

H-Bond Donor