Isobutyl octanoate
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Isobutyl octanoate
structure -
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CAS No:
5461-06-3
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Formula:
C12H24O2
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Chemical Name:
Isobutyl octanoate
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Synonyms:
Octanoic acid,2-methylpropyl ester;Octanoic acid,isobutyl ester;Isobutyl caprylate;Isobutyl octanoate;NSC 23943;2-Methylpropyl octanoate
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CAS No:
Isobutyl octanoate Basic Attributes
200.32
200.32
226-744-8
6GT8657GUF
23943
DTXSID3063916
2915900090
Isobutyl octanoate Use and Manufacturing
Octanoic acid, 2-methylpropyl ester: ACTIVE
Food additives -> Flavoring Agents
Flavoring Agents
Computed Properties
Molecular Weight:200.32
XLogP3:4.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:200.177630004
Monoisotopic Mass:200.177630004
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:141
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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