Dodecyl 2-methylpropanoate
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Dodecyl 2-methylpropanoate
structure -
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CAS No:
6624-71-1
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Formula:
C16H32O2
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Chemical Name:
Dodecyl 2-methylpropanoate
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Synonyms:
Propanoic acid,2-methyl-,dodecyl ester;Isobutyric acid,dodecyl ester;Dodecyl 2-methylpropanoate;Dodecyl isobutyrate;NSC 53823
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CAS No:
Description
Dodecyl isobutyrate is an ester of aliphatic alcohol with branched-chain acyclic acid.
liquid/slightly fruity or practically odourless
Dodecyl 2-methylpropanoate is a carboxylic ester.
Dodecyl 2-methylpropanoate Basic Attributes
256.42
256.42
229-583-1
02470X34WD
53823
DTXSID4064424
2915900090
Characteristics
26.3
6.6
liquid/slightly fruity or practically odourless
0.864g/cm3
-36°C (estimate)
296.8°C at 760 mmHg
134.7ºC
1.438
soluble in organic solvents; insoluble inwater
Dodecyl 2-methylpropanoate Use and Manufacturing
GB 2760-1997 stipulates the permitted food spices.
Propanoic acid, 2-methyl-, dodecyl ester: INACTIVE
Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;
Computed Properties
Molecular Weight:256.42
XLogP3:6.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:13
Exact Mass:256.240230259
Monoisotopic Mass:256.240230259
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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