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2-[7-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]-3,3-dimethyl-1-pentylindole;iodide

2-[7-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]-3,3-dimethyl-1-pentylindole;iodide structure

CAS No:
159021-01-9
Formula:
C37H49IN2
Chemical Name:
2-[7-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]-3,3-dimethyl-1-pentylindole;iodide
Synonyms:
DiIC5(3);dipentyl-3,3,3',3'-tetramethylindocarbocyanine;dipentyl-3,3,3',3'-tetramethylindocarbocyanine iodide;DTXSID40936036;159021-01-9;2-[7-(3,3-Dimethyl-1-pentyl-1,3-dihydro-2H-indol-2-ylidene)hepta-1,3,5-trien-1-yl]-3,3-dimethyl-1-pentyl-3H-indol-1-ium iodide

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2-[7-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]-3,3-dimethyl-1-pentylindole;iodide Basic Attributes

Molecular Weight：

648.7 g/mol

Exact Mass：

648.29405 g/mol

Characteristics

PSA：

6.2 Å²

Drug Information

MeSH Entry Terms：

DiIC5(3)

Computed Properties

Molecular Weight:648.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:12
Exact Mass:648.29405
Monoisotopic Mass:648.29405
Topological Polar Surface Area:6.2
Heavy Atom Count:40
Complexity:871
Undefined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-[7-(3,3-dimethyl-1-pentylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]-3,3-dimethyl-1-pentylindole;iodide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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