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9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)-

9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)- structure

CAS No:
82005-46-7
Formula:
C57H104O6
Chemical Name:
9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)-
Synonyms:
9-Octadecenoic-1-13C acid,1,2,3-propanetriyl ester,(9Z,9′Z,9′′Z)-;9-Octadecenoic-1-13C acid,1,2,3-propanetriyl ester,(Z,Z,Z)-;13C-Triolein

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9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)- Basic Attributes

Molecular Weight：

888.41000

Exact Mass：

887.79300

DSSTox ID：

DTXSID90745832

Characteristics

PSA：

78.90000

XLogP3：

18.09710

Density：

0.916 g/mL at 25ºC(lit.)

Boiling Point：

235-240ºC(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.469(lit.)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Computed Properties

Molecular Weight:888.4
XLogP3:22.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:53
Exact Mass:887.79335554
Monoisotopic Mass:887.79335554
Topological Polar Surface Area:78.9
Heavy Atom Count:63
Complexity:1010
Isotope Atom Count:3
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)-

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)-

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