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Bisabolangelone

Bisabolangelone structure

CAS No:
30557-81-4
Formula:
C15H20O3
Chemical Name:
Bisabolangelone
Synonyms:
4(2H)-Benzofuranone,3,3a,7,7a-tetrahydro-3-hydroxy-3,6-dimethyl-2-(3-methyl-2-buten-1-ylidene)-,(2Z,3R,3aR,7aS)-;4(2H)-Benzofuranone,3,3a,7,7a-tetrahydro-3-hydroxy-3,6-dimethyl-2-(3-methyl-2-butenylidene)-,[3S-(2Z,3α,3aβ,7aβ)]-;Bisabolangelone;4(2H)-Benzofuranone,3,3a,7,7a-tetrahydro-3-hydroxy-3,6-dimethyl-2-(3-methyl-2-butenylidene)-,(2Z,3R,3aR,7aS)-;(2Z,3R,3aR,7aS)-3,3a,7,7a-Tetrahydro-3-hydroxy-3,6-dimethyl-2-(3-methyl-2-buten-1-ylidene)-4(2H)-benzofuranone;Angelikoreanol;Ligustilone;3-Hydroxy-3,6-dimethyl-2-(3-methylbut-2-enylidene)-3,3a,7,7a-tetrahydrobenzofuran-4(2H)-one;(+)-Bisabolangelone;1408-30-6;10208-69-2
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Bisabolangelone Basic Attributes

Molecular Weight：

248.322

Exact Mass：

248.32

Characteristics

PSA：

46.5

XLogP3：

1.8

Density：

1.154±0.06 g/cm3(Predicted)

Melting Point：

157-158 °C

Drug Information

MeSH Entry Terms：

bisabolangelone

Computed Properties

Molecular Weight:248.32
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:248.14124450
Monoisotopic Mass:248.14124450
Topological Polar Surface Area:46.5
Heavy Atom Count:18
Complexity:466
Defined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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China Most Professional Factory Supply High Qulity Bisabolangelone CAS 30557-81-4

CAS No.: 30557-81-4

Grade: Pharmaceutical Grade

Content: 99%

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