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Home > Encyclopedia > 3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE

3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE

3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE structure

3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE 

structure
  • CAS No:

    115920-77-9

  • Formula:

    C33H35IN2S2

  • Chemical Name:

    3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE

3-ETHYL-2-[(1E,3E)-4-(3-((E,2E)-4-[3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]-2-BUTENYLIDENE)-2-METHYL-1-CYCLOHEXEN-1-YL)-1,3-BUTADIENYL]-1,3-BENZOTHIAZOL-3-IUM IODIDE Basic Attributes

650.68

650.129

DTXSID00698921

Characteristics

60.7

5.56300

Computed Properties

Molecular Weight:650.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:650.12864
Monoisotopic Mass:650.12864
Topological Polar Surface Area:60.7
Heavy Atom Count:38
Complexity:900
Defined Bond Stereocenter Count:5
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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