Arctil B
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Arctil B
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CAS No:
102054-39-7
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Formula:
C13H12O2S2
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Chemical Name:
Arctil B
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Synonyms:
Arctinol B;1,2-Ethanediol, 1-[5"-(1-propynyl)[2,2"-bithiophen]-5-yl]- (9CI); 1-[5"-(1-Propyn-1-yl)[2,2"-bithiophen]-5-yl]-1,2-ethanediol;CHEMBL3926695;C13H12O2S2;1,2-Ethanediol, 1-(5"-(1-propynyl)(2,2"-bithiophen)-5-yl)-;1,2-Ethanediol, 1-(5"-(1-propyn-1-yl)(2,2"-bithiophen)-5-yl)-;AKOS032948546;W2368;Q27276770;1-(5"-(Prop-1-yn-1-yl)-[2,2"-bithiophen]-5-yl)ethane-1,2-diol
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CAS No:
Characteristics
96.94000
2.31
1.38±0.1 g/cm3(Predicted)
498.3±45.0 °C(Predicted)
255.1±28.7 °C
1.679
Computed Properties
Molecular Weight:264.4
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:264.02787197
Monoisotopic Mass:264.02787197
Topological Polar Surface Area:96.9
Heavy Atom Count:17
Complexity:320
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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