4-(3,4-Dimethoxyphenyl)-3-butene-1,2-diol
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4-(3,4-Dimethoxyphenyl)-3-butene-1,2-diol
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CAS No:
164661-12-5
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Formula:
C12H16O4
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Chemical Name:
4-(3,4-Dimethoxyphenyl)-3-butene-1,2-diol
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Synonyms:
4-(3,4-Dimethoxyphenyl)-3-butene-1,2-diol;4-(3,4-DiMethoxyphenyl)but-3-ene-1,2-diol
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CAS No:
Characteristics
58.92000
0.70
1.178±0.06 g/cm3(Predicted)
422.3±45.0 °C(Predicted)
209.2±28.7 °C
1.578
Computed Properties
Molecular Weight:224.25
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:224.10485899
Monoisotopic Mass:224.10485899
Topological Polar Surface Area:58.9
Heavy Atom Count:16
Complexity:217
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-(3,4-Dimethoxyphenyl)-3-butene-1,2-diol
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