3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
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3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
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CAS No:
74161-25-4
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Formula:
C20H18O6
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Chemical Name:
3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
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Synonyms:
4H-1-Benzopyran-4-one,3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-;4H-1-Benzopyran-4-one,3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-butenyl)-;3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one;2,3-Dehydrokievitone
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CAS No:
3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one Basic Attributes
354.358
354.35
M463PIR1IG
DTXSID10225121
Characteristics
111.13000
5.08
1.4±0.1 g/cm3
633.0±55.0 °C at 760 mmHg
229.8±25.0 °C
1.690
2.076 mg/L @ 25 °C (est)
3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one Use and Manufacturing
Polyketides [PK] -> Flavonoids [PK12] -> Isoflavonoids [PK1205]
Computed Properties
Molecular Weight:354.4
XLogP3:4.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:354.11033829
Monoisotopic Mass:354.11033829
Topological Polar Surface Area:107
Heavy Atom Count:26
Complexity:593
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
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