Octyl 2-butenoate
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Octyl 2-butenoate
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CAS No:
22874-79-9
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Formula:
C12H22O2
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Chemical Name:
Octyl 2-butenoate
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Synonyms:
2-Butenoic acid,octyl ester;Crotonic acid,octyl ester;Octyl 2-butenoate;NSC 67892
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CAS No:
Characteristics
26.30000
3.46620
0.886 g/cm3
107-108 °C @ Press: 5 Torr
118.8ºC
1.444
0.0168mmHg at 25°C
Computed Properties
Molecular Weight:198.30
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:198.161979940
Monoisotopic Mass:198.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:162
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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