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84109-09-1

84109-09-1 | 3H-Indolium, 2-(3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-yl idene)-1-propenyl)-3,3-dimethyl-1-tetradecyl-

CAS No: 84109-09-1 Catalog No: AG00GDMG MDL No:

Product Description

Catalog Number:
AG00GDMG
Chemical Name:
3H-Indolium, 2-(3-(1,3-dihydro-3,3-dimethyl-1-tetradecyl-2H-indol-2-yl idene)-1-propenyl)-3,3-dimethyl-1-tetradecyl-
CAS Number:
84109-09-1
IUPAC Name:
(2Z)-2-[(E)-3-(3,3-dimethyl-1-tetradecylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-1-tetradecylindole
InChI:
InChI=1S/C51H81N2/c1-7-9-11-13-15-17-19-21-23-25-27-33-42-52-46-38-31-29-36-44(46)50(3,4)48(52)40-35-41-49-51(5,6)45-37-30-32-39-47(45)53(49)43-34-28-26-24-22-20-18-16-14-12-10-8-2/h29-32,35-41H,7-28,33-34,42-43H2,1-6H3/q+1
InChI Key:
UCPAVVVTWGHRBV-UHFFFAOYSA-N

Properties

Complexity:
994  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2  
Exact Mass:
721.64g/mol
Formal Charge:
1  
Heavy Atom Count:
53  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
722.223g/mol
Monoisotopic Mass:
721.64g/mol
Rotatable Bond Count:
28  
Topological Polar Surface Area:
6.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
18.9  

Literature

Title Journal
Organization of the torus longitudinalis in the rainbow trout (Oncorhynchus mykiss): an immunohistochemical study of the GABAergic system and a DiI tract-tracing study. The Journal of comparative neurology 20070710

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