(3-chlorophenyl)methyl 9,10,10-trioxothioxanthene-3-carboxylate
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(3-chlorophenyl)methyl 9,10,10-trioxothioxanthene-3-carboxylate
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CAS No:
485762-49-0
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Formula:
C21H13ClO5S
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Chemical Name:
(3-chlorophenyl)methyl 9,10,10-trioxothioxanthene-3-carboxylate
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Synonyms:
Oprea1_530838;ZINC3264158;AKOS033710450;MCULE-7824617704;Z19802579;(3-chlorophenyl)methyl 9,10,10-trioxo-9H-10lambda6-thioxanthene-3-carboxylate;485762-49-0
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CAS No:
(3-chlorophenyl)methyl 9,10,10-trioxothioxanthene-3-carboxylate Basic Attributes
412.8 g/mol
412.0172224 g/mol
Computed Properties
Molecular Weight:412.8
XLogP3:4.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:412.0172224
Monoisotopic Mass:412.0172224
Topological Polar Surface Area:85.9
Heavy Atom Count:28
Complexity:715
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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