1-O-prop-2-ynyl 2-O-(2,4,6-tribromophenyl) benzene-1,2-dicarboxylate
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1-O-prop-2-ynyl 2-O-(2,4,6-tribromophenyl) benzene-1,2-dicarboxylate
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CAS No:
330460-32-7
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Formula:
C17H9Br3O4
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Chemical Name:
1-O-prop-2-ynyl 2-O-(2,4,6-tribromophenyl) benzene-1,2-dicarboxylate
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Synonyms:
2-propyn-1-yl 2,4,6-tribromophenyl phthalate;CHEBI:75345;CBChromo1_000209;Probes1_000181;Probes2_000348;C17H9Br3O4;CBDivE_009118;CHEMBL2447898;ZINC2273145;STL326254;1-O-prop-2-ynyl 2-O-(2,4,6-tribromophenyl) benzene-1,2-dicarboxylate;AKOS000560251;MCULE-8880574796;ST097340;prop-2-yn-1-yl 2,4,6-tribromophenyl phthalate;Q27145230;2,4,6-tribromophenyl 2-(prop-2-ynyloxycarbonyl)benzoate;prop-2-yn-1-yl 2,4,6-tribromophenyl benzene-1,2-dicarboxylate;330460-32-7
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CAS No:
Description
2-propyn-1-yl 2,4,6-tribromophenyl phthalate is a phthalate ester that is the mixed diester obtained by the formal condensation of carboxy groups of phthalic acid with hydroxy groups of 2,4,6-tribromophenol and prop-2-yn-1-ol respectively. It is an organobromine compound, a phthalate ester and a terminal acetylenic compound. It derives from a 2,4,6-tribromophenol and a prop-2-yn-1-ol.
1-O-prop-2-ynyl 2-O-(2,4,6-tribromophenyl) benzene-1,2-dicarboxylate Basic Attributes
517.0 g/mol
515.80305 g/mol
Computed Properties
Molecular Weight:517.0
XLogP3:5.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:515.80305
Monoisotopic Mass:513.80510
Topological Polar Surface Area:52.6
Heavy Atom Count:24
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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