3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE

CAS No.
3071-70-3
CCD No.
CCD00027731
Formula
C25 H25 N2 S2 . I
MolWeight
544.518

Basic Information

Product Name: 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE
CAS: 3071-70-3
English Synonyms: THIATRICARBOCYANINE IODIDE, 3,3'-DIETHYL- ; DTTC IODIDE ; DTTC ; 3,3'-DIETHYLTHIATRICARBOCYANINE IODIDE ; BENZOTHIAZOLIUM, 3-ETHYL-2-[7-(3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE)-1,3,5-HEPTATRIENYL]-, IODIDE ; 3-ETHYL-2-((1E,3E,5E)-7-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-1,3,5-HEPTATRIENYL)-1,3-BENZOTHIAZOL-3-IUM IODIDE ; BENZOTHIAZOLIUM, 3-ETHYL-2-[7-(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)-1,3,5-HEPTATRIENYL]-, IODIDE ; DISC2(7) ; 3,3'-DIETHYL-2,2'-THIATRICARBOCYANINE IODIDE ; DTTCI ; 3-ETHYL-2-[7-(3-ETHYL-2-BENZOTHIAZOLINYLIDENE)-1,3,5-HEPTATRIENYL]BENZOTHIAZOLIUM IODIDE
MDL Number.: MFCD00041994
H bond acceptor: 2
H bond donor: 0
Smile: CC[n+]1c2ccccc2sc1/C=C/C=C/C=C/C=C\3/N(c4ccccc4S3)CC.[I-]
InChi: InChI=1S/C25H25N2S2.HI/c1-3-26-20-14-10-12-16-22(20)28-24(26)18-8-6-5-7-9-19-25-27(4-2)21-15-11-13-17-23(21)29-25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1
InChiKey: InChIKey=OYVFJKVYVDYPFV-UHFFFAOYSA-M

Property

Melting Point: 211 DEG C (DEC)(LIT)
Comments: APPLICATION: IR DYE
RTECS: DL7045000
UNSPSC: 12171500
UV ABSORPTION: LAMBDAMAX 765 NM
WGK: 3

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H302-H312-H315-H319-H332-H335
Precautionary statements: P261-P280-P305 + P351 + P338
WGK Germany: 3

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