2,5-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM ETHYL SULFATE

CAS No.
54749-06-3
CCD No.
CCD00065178
Formula
C11 H14 N S . C2 H5 O4 S
MolWeight
317.428

Basic Information

Product Name: 2,5-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM ETHYL SULFATE
CAS: 54749-06-3
English Synonyms: 2,5-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM ETHYL SULFATE
MDL Number.: MFCD00134771
H bond acceptor: 1
H bond donor: 0
Smile: CC[n+]1c(sc2c1cc(cc2)C)C.CCOS(=O)(=O)[O-]
InChi: InChI=1S/C11H14NS.C2H6O4S/c1-4-12-9(3)13-11-6-5-8(2)7-10(11)12;1-2-6-7(3,4)5/h5-7H,4H2,1-3H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
InChiKey: InChIKey=ZBBVKAMYEBNXSB-UHFFFAOYSA-M

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