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Heptan-3-Yl Octanoate
[CAS# 5457-74-9]

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CAS#: 5457-74-9
Product: Heptan-3-Yl Octanoate
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Identification
Name Heptan-3-Yl Octanoate
Synonyms 1-Ethylpentyl Octanoate; Octanoic Acid 1-Ethylpentyl Ester; Caprylic Acid 1-Ethylpentyl Ester
Molecular Structure CAS#: 5457-74-9, Heptan-3-Yl Octanoate
Molecular Formula C15H30O2
Molecular Weight 242.40
CAS Registry Number 5457-74-9
SMILES C(C)CCC(CC)OC(CCCCCCC)=O
InChI 1S/C15H30O2/c1-4-7-9-10-11-13-15(16)17-14(6-3)12-8-5-2/h14H,4-13H2,1-3H3
InChIKey XIWKFLBGDLYRDD-UHFFFAOYSA-N
Properties
Density 0.866g/cm3 (Cal.)
Boiling point 281.345°C at 760 mmHg (Cal.)
Flash point 124.987°C (Cal.)
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