3,3'-Diethyl-9-methylthiacarbocyanine iodide

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Names

[ CAS No. ]:
3065-79-0

[ Name ]:
3,3'-Diethyl-9-methylthiacarbocyanine iodide

[Synonym ]:
3,3′-Diethyl-9-methylthiacarbocyanine iodide
Benzothiazolium,3-ethyl-2-(3-(3-ethyl-2(3H)-benzothiazolylidene)-2-methyl-1-propenyl)-,iodide
3-ethyl-2-[3-(3-ethyl-3H-benzothiazol-2-ylidene)-2-methyl-propenyl]-benzothiazolium,iodide
1,3-Bis-(3-aethyl-benzothiazol-2-yl)-2-methyl-trimethinium,Jodid
MFCD00011955
3,3'-Diethyl-9-methylthiocarbocyanin Iodid (11b)
Benzothiazolium,3-ethyl-2-(3-(3-ethyl-2-benzothiazolinylidene)-2-methyl-1-propenyl)-,iodide
1,3-bis-(3-ethyl-benzothiazol-2-yl)-2-methyl-trimethinium,iodide
3,3'-Diethyl-9-methylthiacarbocyanine iodide
T0500-8750
3-Ethyl-2-(3-(3-ethyl-3H-benzothiazol-2-ylidene)-2-methylprop-1-enyl)benzothiazolium iodide
3-ethyl-2-[3-(3-ethyl-3H-2-benzothiazolylidene)-2-methyl-1-propenyl] benzothiazolium iodide
EINECS 221-317-2

Chemical & Physical Properties

[ Melting Point ]:
290ºC(dec.)(lit.)

[ Molecular Formula ]:
C22H23IN2S2

[ Molecular Weight ]:
506.46600

[ Exact Mass ]:
506.03500

[ PSA ]:
65.29000

[ LogP ]:
2.41390

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DL7047000
CHEMICAL NAME :
Benzothiazolium, 3-ethyl-2-(3-(3-ethyl-2-benzothiazolinylidene)-2-meth yl-1-propenyl)-, iodide
CAS REGISTRY NUMBER :
3065-79-0
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C22-H23-N2-S2.I
MOLECULAR WEIGHT :
506.49
WISWESSER LINE NOTATION :
T56 BNYSJ B2 CU2U1- CT56 BK DSJ B2 G1 &I

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3600 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03432

Safety Information

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S36

[ WGK Germany ]:
3

[ RTECS ]:
DL7047000

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 3,3'-diethyl-9-aminothiacarbocyanine iodide
  • 3,3'-diethyl-9-methoxythiacarbocyanine iodide
  • 3,3'-DIETHYL-9,11-NEOPENTYLENETHIATETRACARBOCYANINE IODIDE
  • 3,3'-diethyl-9,11,13(penta-1'',3'',5''-triyl)-thiatricarbocyanine iodide
  • 3,3'-diethyl-9,11,9',11'-bis(b,b-dimethyltrimethylene)-thiapentacarbocyanine iodide
  • 3,3'-Diethyl[9,9'-bianthracene]-10,10'(9H,9'H)-dione
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide
  • N-[3-(Aminooxy)propyl]-N-butyl-1-butanamine