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Pratensein

Pratensein structure

CAS No:
2284-31-3
Formula:
C16H12O6
Chemical Name:
Pratensein
Synonyms:
4H-1-Benzopyran-4-one,5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-;Isoflavone,3′,5,7-trihydroxy-4′-methoxy-;5,7-Dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one;Pratensein;4′-O-Methylorobol;Pratenseine;3′-Hydroxybiochanin A
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

ChEBI: A member of the class of 7-hydroxyisoflavones in which isoflavone is substituted by hydroxy groups at the 5, 7, and 3' positions, and by a methoxy group at the 4' position.

Solid

Pratensein is a member of the class of 7-hydroxyisoflavones in which isoflavone is substituted by hydroxy groups at the 5, 7, and 3' positions, and by a methoxy group at the 4' position. It is a member of 7-hydroxyisoflavones and a member of 4'-methoxyisoflavones. It is a conjugate acid of a pratensein(1-).

Pratensein Basic Attributes

Molecular Weight：

300.266

Exact Mass：

300.26

UNII：

D2CF8CJ6AP

DSSTox ID：

DTXSID60177388

HScode：

2914509090

Characteristics

PSA：

96.2

XLogP3：

2.58540

Appearance：

Solid

Density：

1.512g/cm3

Melting Point：

271-273 °C

Boiling Point：

576.7ºC at 760mmHg

Flash Point：

220.3ºC

Refractive Index：

1.697

Drug Information

MeSH Entry Terms：

4'-methoxy-3',5,7-trihydroxyisoflavone

Pratensein Use and Manufacturing

Use Classification：

Polyketides [PK] -> Flavonoids [PK12] -> Isoflavonoids [PK1205]

Computed Properties

Molecular Weight:300.26
XLogP3:2.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:300.06338810
Monoisotopic Mass:300.06338810
Topological Polar Surface Area:96.2
Heavy Atom Count:22
Complexity:462
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 2284-31-3

Grade: Industrial Grade

Content: 99%

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