Ethyl 2-cyano-3-methylhexanoate
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Ethyl 2-cyano-3-methylhexanoate
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CAS No:
19823-28-0
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Formula:
C10H17NO2
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Chemical Name:
Ethyl 2-cyano-3-methylhexanoate
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Synonyms:
Hexanoic acid,2-cyano-3-methyl-,ethyl ester;Ethyl 2-cyano-3-methylhexanoate;NSC 46918;2-Cyano-3-methyl-hexanoic acid ethyl ester
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CAS No:
Characteristics
50.09000
2.12548
0.8991 g/cm3 @ Temp: 86.5 °C
101.5 °C @ Press: 4 Torr
125ºC
1.435
0.098mmHg at 25°C
Computed Properties
Molecular Weight:183.25
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:183.125928785
Monoisotopic Mass:183.125928785
Topological Polar Surface Area:50.1
Heavy Atom Count:13
Complexity:204
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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