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n-Caprylic Acid Isobutyl Ester
[CAS# 5461-06-3]

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Identification
Classification Flavors and spices >> Synthetic spice >> Carboxylic acid and ester perfume >> Aliphatic carboxylate
Name n-Caprylic Acid Isobutyl Ester
Synonyms Isobutyl Octanoate; Octanoic Acid Isobutyl Ester; Caprylic Acid Isobutyl Ester
Molecular Structure CAS#: 5461-06-3, n-Caprylic Acid Isobutyl Ester
Molecular Formula C12H24O2
Molecular Weight 200.32
CAS Registry Number 5461-06-3
EINECS 226-744-8
SMILES C(C(C)C)OC(=O)CCCCCCC
InChI 1S/C12H24O2/c1-4-5-6-7-8-9-12(13)14-10-11(2)3/h11H,4-10H2,1-3H3
InChIKey CFQRBRGFNFRMBD-UHFFFAOYSA-N
Properties
Density 0.869g/cm3 (Cal.)
Boiling point 231.855°C at 760 mmHg (Cal.)
Flash point 94.01°C (Cal.)
Safety Data
SDS Available
Market Analysis Reports
List of Reports Available for n-Caprylic Acid Isobutyl Ester
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