2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium
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2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium
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CAS No:
356062-62-9
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Formula:
C36H39N2.F6P
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Chemical Name:
2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium
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Synonyms:
2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium;2-[3-(3-Butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1H-benz[e]indolium hexafluorophosphate(1-) (1:1);1H-Benz[e]indolium, 2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propenyl]-1,1,3-trimethyl-, hexafluorophosphate(1-);2-[3-(3-Butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1H-benz[e]indolium hexafluorophosphate (1:1);2-[3-(3-Butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,3,3-trimethyl-3H-benz[g]indolium hexafluorophosphate (1:1)
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CAS No:
2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium Basic Attributes
644.68
644.27600
Computed Properties
Molecular Weight:644.7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:644.27550522
Monoisotopic Mass:644.27550522
Topological Polar Surface Area:6.2
Heavy Atom Count:45
Complexity:1030
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium
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