Home Other Building Blocks 1,1',3,3,3',3'-HEXAMETHYLINDOTRICARBOCYANINE IODIDE

1,1',3,3,3',3'-HEXAMETHYLINDOTRICARBOCYANINE IODIDE

CAS No.:
19764-96-6
Catalog Number:
AG00ACPA
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00ACPA
Chemical Name:
1,1',3,3,3',3'-HEXAMETHYLINDOTRICARBOCYANINE IODIDE
CAS Number:
19764-96-6
MDL Number:
MFCD00011950
IUPAC Name:
1,3,3-trimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indole;iodide
InChI:
InChI=1S/C29H33N2.HI/c1-28(2)22-16-12-14-18-24(22)30(5)26(28)20-10-8-7-9-11-21-27-29(3,4)23-17-13-15-19-25(23)31(27)6;/h7-21H,1-6H3;1H/q+1;/p-1
InChI Key:
JKXWXYURKUEZHV-UHFFFAOYSA-M
EC Number:
243-282-2
Properties
Complexity:
756  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.169g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
536.501g/mol
Monoisotopic Mass:
536.169g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
6.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
4  
Properties