1,1′-(1,4-Butanediyl) dioctanoate
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1,1′-(1,4-Butanediyl) dioctanoate
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CAS No:
109-41-1
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Formula:
C20H38O4
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Chemical Name:
1,1′-(1,4-Butanediyl) dioctanoate
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Synonyms:
Octanoic acid,1,1′-(1,4-butanediyl) ester;Octanoic acid,tetramethylene ester;Octanoic acid,1,4-butanediyl ester;1,4-Butanediol,dioctanoate;1,1′-(1,4-Butanediyl) dioctanoate;Tetramethylene dicaprylate;NSC 6378
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CAS No:
Characteristics
52.60000
5.57400
0.936g/cm3
180-190 °C @ Press: 0.3 Torr
198ºC
1.449
2.34E-07mmHg at 25°C
Computed Properties
Molecular Weight:342.5
XLogP3:6.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:19
Exact Mass:342.27700969
Monoisotopic Mass:342.27700969
Topological Polar Surface Area:52.6
Heavy Atom Count:24
Complexity:272
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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