Combretastatin A1
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Combretastatin A1
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CAS No:
109971-63-3
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Formula:
C18H20O6
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Chemical Name:
Combretastatin A1
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Synonyms:
1,2-Benzenediol,3-methoxy-6-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]-;1,2-Benzenediol,3-methoxy-6-[2-(3,4,5-trimethoxyphenyl)ethenyl]-,(Z)-;3-Methoxy-6-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,2-benzenediol;Combretastatin A1;OXi 4500
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CAS No:
Characteristics
77.38000
3.84
1.251±0.06 g/cm3(Predicted)
113-115 °C @ Solvent: Chloroform, Hexane
528.4±50.0 °C(Predicted)
273.3±30.1 °C
1.627
8.82E-12mmHg at 25°C
Computed Properties
Molecular Weight:332.3
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:332.12598835
Monoisotopic Mass:332.12598835
Topological Polar Surface Area:77.4
Heavy Atom Count:24
Complexity:387
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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