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Octyl Hydrogen Adipate
[CAS# 17961-12-5]

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Identification
Name Octyl Hydrogen Adipate
Synonyms 6-Octoxy-6-Oxo-Hexanoic Acid; 6-Keto-6-Octoxy-Hexanoic Acid
Molecular Structure CAS#: 17961-12-5, Octyl Hydrogen Adipate
Molecular Formula C14H26O4
Molecular Weight 258.36
CAS Registry Number 17961-12-5
EINECS 241-885-5
SMILES C(C(=O)O)CCCC(=O)OCCCCCCCC
InChI 1S/C14H26O4/c1-2-3-4-5-6-9-12-18-14(17)11-8-7-10-13(15)16/h2-12H2,1H3,(H,15,16)
InChIKey IHLDEDLAZNFOJB-UHFFFAOYSA-N
Properties
Density 1.002g/cm3 (Cal.)
Boiling point 375.564°C at 760 mmHg (Cal.)
Flash point 130.155°C (Cal.)
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