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Phenyl Octanoate
[CAS# 5457-78-3]

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CAS#: 5457-78-3
Product: Phenyl Octanoate
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Identification
Name Phenyl Octanoate
Synonyms Caprylic Acid Phenyl Ester; Octanoic Acid, Phenyl Ester; Phenyl Octanoate
Molecular Structure CAS#: 5457-78-3, Phenyl Octanoate
Molecular Formula C14H20O2
Molecular Weight 220.31
CAS Registry Number 5457-78-3
SMILES C1=C(OC(=O)CCCCCCC)C=CC=C1
InChI 1S/C14H20O2/c1-2-3-4-5-9-12-14(15)16-13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey ZBZSVGXZAPNCSY-UHFFFAOYSA-N
Properties
Density 0.974g/cm3 (Cal.)
Boiling point 302.534°C at 760 mmHg (Cal.)
Flash point 108.576°C (Cal.)
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