DTXSID3,3-Bis(3,5-dibromo-4-hydroxy-2-methylphenyl)-2,1lambda~6~-benzoxathiole-1,1(3H)-dione--strychnidin-10-one (1/1)
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DTXSID3,3-Bis(3,5-dibromo-4-hydroxy-2-methylphenyl)-2,1lambda~6~-benzoxathiole-1,1(3H)-dione--strychnidin-10-one (1/1)
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CAS No:
101686-74-2
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Formula:
C42H36Br4N2O7S
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Chemical Name:
DTXSID3,3-Bis(3,5-dibromo-4-hydroxy-2-methylphenyl)-2,1lambda~6~-benzoxathiole-1,1(3H)-dione--strychnidin-10-one (1/1)
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Synonyms:
101686-74-2;DTXSID90906486;Phenol, 4,4'-(3H-2,1-benzoxathiol-3-ylidene)bis(2,6-dibromo-3-methyl-, S,S-dioxide, compd. with strychnidin-10-one (1:1);3,3-Bis(3,5-dibromo-4-hydroxy-2-methylphenyl)-2,1lambda~6~-benzoxathiole-1,1(3H)-dione--strychnidin-10-one (1/1)
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CAS No:
DTXSID3,3-Bis(3,5-dibromo-4-hydroxy-2-methylphenyl)-2,1lambda~6~-benzoxathiole-1,1(3H)-dione--strychnidin-10-one (1/1) Basic Attributes
1032.4 g/mol
1031.89357 g/mol
Computed Properties
Molecular Weight:1032.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:1031.89357
Monoisotopic Mass:1027.89767
Topological Polar Surface Area:125
Heavy Atom Count:56
Complexity:1430
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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