3,3'-DIETHYLTHIACYANINE ETHYLSULFATE

CAS No.
2602-17-7
CCD No.
CCD00434650
Formula
C19 H19 N2 S2 . C2 H5 O4 S
MolWeight
464.629

Basic Information

Product Name: 3,3'-DIETHYLTHIACYANINE ETHYLSULFATE
CAS: 2602-17-7
English Synonyms: 3,3'-DIETHYLTHIACYANINE ETHYLSULFATE ; 3,3'-DIETHYLTHIAMONOMETHINECYANINE ETHYL SULFATE
MDL Number.: MFCD03940778
H bond acceptor: 2
H bond donor: 0
Smile: CC[n+]1c2ccccc2sc1/C=C/3\N(c4ccccc4S3)CC.CCOS(=O)(=O)[O-]
InChi: InChI=1S/C19H19N2S2.C2H6O4S/c1-3-20-14-9-5-7-11-16(14)22-18(20)13-19-21(4-2)15-10-6-8-12-17(15)23-19;1-2-6-7(3,4)5/h5-13H,3-4H2,1-2H3;2H2,1H3,(H,3,4,5)/q+1;/p-1
InChiKey: InChIKey=NLGSCOPBXPXNRT-UHFFFAOYSA-M

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