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Flavokawain A

Flavokawain A structure

CAS No:
37951-13-6
Formula:
C18H18O5
Chemical Name:
Flavokawain A
Synonyms:
2-Propen-1-one,1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)-,(2E)-;2-Propen-1-one,1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)-,(E)-;(2E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)-2-propen-1-one;Flavokawain A;Flavokavin A;4-Methoxyflavokawain B;(E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one;64680-84-8
Categories:
Natural Products > Lignans

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Description

Solid

Flavokawain A is a member of chalcones.

Flavokawain A Basic Attributes

Molecular Weight：

314.33

Exact Mass：

314.33

NSC Number：

37445

Characteristics

PSA：

64.99000

XLogP3：

3.31410

Density：

1?+-.0.06 g/cm3

Melting Point：

109-110 °C @ Solvent: Ethanol

Boiling Point：

529.9±50.0 °C(Predicted)

Water Solubility：

10.02 mg/L @ 25 °C (est)

PKA：

6.88±0.40

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

flavokavin A

Computed Properties

Molecular Weight:314.3
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:314.11542367
Monoisotopic Mass:314.11542367
Topological Polar Surface Area:65
Heavy Atom Count:23
Complexity:400
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 37951-13-6

Grade: Pharmaceutical grade

Content: 99%

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Guide of Flavokawain A

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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