2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid
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2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid
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CAS No:
61719-87-7
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Formula:
C10H6Cl6O5S
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Chemical Name:
2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid
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Synonyms:
MLS002638458;61719-87-7;NSC15910;SCHEMBL7794861;CHEMBL1905689;DTXSID20977306;HMS3089H22;4-(3-fluorobenzyloxy)-benzaldehyde;NSC-15910;SMR001547937;A8983;2,4-Bis(trichloromethyl)-2H,4H-1,3-benzodioxine-6-sulfonic acid
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CAS No:
2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid Basic Attributes
450.9 g/mol
449.803761 g/mol
15910
Computed Properties
Molecular Weight:450.9
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:449.803761
Monoisotopic Mass:447.806711
Topological Polar Surface Area:81.2
Heavy Atom Count:22
Complexity:509
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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