9,10-Epoxystearic acid
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9,10-Epoxystearic acid
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CAS No:
2443-39-2
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Formula:
C18H34O3
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Chemical Name:
9,10-Epoxystearic acid
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Synonyms:
2-Oxiraneoctanoic acid,3-octyl-;Octadecanoic acid,9,10-epoxy-;Oxiraneoctanoic acid,3-octyl-;Stearic acid,θ,ι-epoxy-;3-Octyl-2-oxiraneoctanoic acid;9,10-Epoxystearic acid;9,10-Epoxyoctadecanoic acid;Oleic acid epoxide;NSC 179691;3-Octyloxiraneoctanoic acid;52275-14-6
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CAS No:
Description
9,10-epoxyoctadecanoic acid is an epoxy fatty acid consisting of octadecanoic (stearic) acid with a single epoxide located between positions 9 and 10. It has a role as a human metabolite. It is a conjugate acid of a 9,10-epoxyoctadecanoate.
Characteristics
49.83000
5.31970
0.918 g/cm3 @ Temp: 20 °C
53.8 °C
170-190 °C @ Press: 2 Torr
141.1ºC
1.467
−20°C
9,10-Epoxystearic acid Use and Manufacturing
An epoxy fatty acid found in Pneumocystis carinii lipids.
Fatty Acyls [FA] -> Octadecanoids [FA02] -> Other Octadecanoids [FA0200]
Computed Properties
Molecular Weight:298.5
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:15
Exact Mass:298.25079494
Monoisotopic Mass:298.25079494
Topological Polar Surface Area:49.8
Heavy Atom Count:21
Complexity:265
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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