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53290-46-3

53290-46-3 | 1,1'-DIPENTYL-3,3,3',3'-TETRAMETHYLINDOCARBOCYANINE IODIDE

CAS No: 53290-46-3 Catalog No: AG00DH3F MDL No:

Product Description

Catalog Number:
AG00DH3F
Chemical Name:
1,1'-DIPENTYL-3,3,3',3'-TETRAMETHYLINDOCARBOCYANINE IODIDE
CAS Number:
53290-46-3
IUPAC Name:
(2Z)-2-[(E)-3-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-1-pentylindole;iodide
InChI:
InChI=1S/C33H45N2.HI/c1-7-9-15-24-34-28-20-13-11-18-26(28)32(3,4)30(34)22-17-23-31-33(5,6)27-19-12-14-21-29(27)35(31)25-16-10-8-2;/h11-14,17-23H,7-10,15-16,24-25H2,1-6H3;1H/q+1;/p-1
InChI Key:
LCAMKACNMQKEIG-UHFFFAOYSA-M

Properties

Complexity:
734  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2  
Exact Mass:
596.263g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
596.641g/mol
Monoisotopic Mass:
596.263g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
6.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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