2-[2-[(3-ethyl-5-methoxybenzothiazol-2(3H)-ylidene)methyl]but-1-enyl]-5-methoxy-3-(3-sulphonatopropyl)benzothiazolium

Modify Date: 2025-09-12 22:49:52

2-[2-[(3-ethyl-5-methoxybenzothiazol-2(3H)-ylidene)methyl]but-1-enyl]-5-methoxy-3-(3-sulphonatopropyl)benzothiazolium Structure
2-[2-[(3-ethyl-5-methoxybenzothiazol-2(3H)-ylidene)methyl]but-1-enyl]-5-methoxy-3-(3-sulphonatopropyl)benzothiazolium structure
Common Name 2-[2-[(3-ethyl-5-methoxybenzothiazol-2(3H)-ylidene)methyl]but-1-enyl]-5-methoxy-3-(3-sulphonatopropyl)benzothiazolium
CAS Number 14637-08-2 Molecular Weight 546.72200
Density N/A Boiling Point N/A
Molecular Formula C26H30N2O5S3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-[2-[2-[(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)methyl]but-1-enyl]-5-methoxy-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate

 Chemical & Physical Properties

Molecular Formula C26H30N2O5S3
Molecular Weight 546.72200
Exact Mass 546.13200
PSA 167.05000
LogP 5.37790
InChIKey BPVXRCNZOAFWOB-UHFFFAOYSA-N
SMILES CCC(=Cc1sc2ccc(OC)cc2[n+]1CCCS(=O)(=O)[O-])C=C1Sc2ccc(OC)cc2N1CC
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