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Home > Encyclopedia > 2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt

2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt

2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt structure

2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt 

structure
  • CAS No:

    120724-84-7

  • Formula:

    C31H39N2O6S2.Na

  • Chemical Name:

    2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt

  • Synonyms:

    3,3,3",3"-Tetramethyl-1,1"-bis(4-sulfobutyl)indocarbocyanine Sodium Salt;D4464;2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium Hydroxide Inner Salt Sodium Salt;3-[3,3-Dimethyl-1-(4-sulfonatobutyl)indolin-2-ylidene]-1-[3,3-dimethyl-1-(4-sulfonatobutyl)indolium-2-yl]-1

  • Categories:

    Organic Chemistry  >  Coordination Complexes

2-[3-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]propenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt Basic Attributes

622.77

622.21500

Characteristics

137.41000

7.13690

Computed Properties

Molecular Weight:622.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:622.21472360
Monoisotopic Mass:622.21472360
Topological Polar Surface Area:137
Heavy Atom Count:42
Complexity:1120
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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