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Home > Products > Pharmaceutical R&D Materials > Heterocyclic Building Blocks > 2-[3-(3-Ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl]-3-[3-(sulfooxy)-butyl]benzothiazoliumHydroxide.innersalt
2-[3-(3-Ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl]-3-[3-(sulfooxy)-butyl]benzothiazoliumHydroxide.innersalt structure, CAS 28789-08-4

2-[3-(3-Ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl]-3-[3-(sulfooxy)-butyl]benzothiazoliumHydroxide.innersalt

CAS Number28789-08-4

Synonyms3-ETHYL-3'-(3-SULFOBUTYL)-9-METHYL-BENZTHIAZOLO-TRIMETHINECYANINEBETAINE

Molecular FormulaC20H23BrN2O

Molecular Weight387.323

Purity

Density

Boiling Point

Melting Point240ºC (dec.)(lit.)

Flash Point

Appearance

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9083034 Purity:
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Quality Control of [ 28789-08-4 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number28789-08-4
Catalog No.2A-9083034
Chinese Name2-[3-(3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE)-2-METHYL-1-PROPENYL]-3-[3-(SULFOOXY)-BUTYL]BENZOTHIAZOLIUM
Synonyms3-ETHYL-3'-(3-SULFOBUTYL)-9-METHYL-BENZTHIAZOLO-TRIMETHINECYANINEBETAINE
Molecular FormulaC20H23BrN2O
Molecular Weight387.323
Melting Point240ºC (dec.)(lit.)
MDL NumberMFCD01848327
SMILESCCN1C(=CC(C)=Cc2sc3ccccc3[n+]2CCC(C)S(=O)(=O)[O-])Sc2ccccc21
InChIInChI=1S/C24H26N2O3S3/c1-4-25-19-9-5-7-11-21(19)30-23(25)15-17(2)16-24-26(14-13-18(3)32(27,28)29)20-10-6-8-12-22(20)31-24/h5-12,15-16,18H,4,13-14H2,1-3H3
InChI KeyHHGWLRNRKVHQRS-UHFFFAOYSA-N
MSDSmsds/83034_1_28789_08_4.pdf
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