1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate
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![1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/63301783d9164468bf8939182bf7be8d.png "1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate")
1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate
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CAS No:
67874-06-0
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Formula:
C29H54O6
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Chemical Name:
1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate
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Synonyms:
Octanoic acid,1,1′-[2-methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] ester;Octanoic acid,2-methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl ester;Octanoic acid,triester with 2-(hydroxymethyl)-2-methyl-1,3-propanediol;1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate;Trimethylolethane trioctanoate;2-(Hydroxymethyl)-2-methyl-1,3-propanediol trioctanoate;Trimethylolethane tricaprylate
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CAS No:
1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate Basic Attributes
498.7 g/mol
498.74
1,1′-[2-Methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] dioctanoate Use and Manufacturing
Octanoic acid, 1,1'-[2-methyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] ester: INACTIVE
Computed Properties
Molecular Weight:498.7
XLogP3:9.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:27
Exact Mass:498.39203944
Monoisotopic Mass:498.39203944
Topological Polar Surface Area:78.9
Heavy Atom Count:35
Complexity:471
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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