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68220-31-5

68220-31-5 structure

68220-31-5 

structure
  • CAS No:

    68220-31-5

  • Formula:

    C43H53N2O4S2.ClO4

  • Chemical Name:

    68220-31-5

  • Synonyms:

    Benzothiazolium,3-ethyl-2-[[3-[3-[3-[(3-ethyl-5,6-dimethoxy-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propen-1-yl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-5,6-dimethoxy-,perchlorate (1:1);Benzothiazolium,3-ethyl-2-[[3-[3-[3-[(3-ethyl-5,6-dimethoxy-2(3H)-benzothiazolylidene)methyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]-1-propenyl]-5,5-dimethyl-2-cyclohexen-1-ylidene]methyl]-5,6-dimethoxy-,perchlorate

68220-31-5 Basic Attributes

825.47252

824.293

269-322-9

DTXSID10218396

Characteristics

172

10.61410

Computed Properties

Molecular Weight:825.5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:824.2931867
Monoisotopic Mass:824.2931867
Topological Polar Surface Area:172
Heavy Atom Count:56
Complexity:1420
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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