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Nonanoic Acid 3-Methylbutyl Ester
[CAS# 7779-70-6]

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Identification
Name Nonanoic Acid 3-Methylbutyl Ester
Synonyms Isopentyl Nonanoate; Nonanoic Acid Isopentyl Ester; Pelargonic Acid Isoamyl Ester
Molecular Structure CAS#: 7779-70-6, Nonanoic Acid 3-Methylbutyl Ester
Molecular Formula C14H28O2
Molecular Weight 228.37
CAS Registry Number 7779-70-6
EINECS 231-933-3
FEMA 2078
SMILES C(C)CCCCCCC(OCCC(C)C)=O
InChI 1S/C14H28O2/c1-4-5-6-7-8-9-10-14(15)16-12-11-13(2)3/h13H,4-12H2,1-3H3
InChIKey SHGMLOSSRPFLKG-UHFFFAOYSA-N
Properties
Density 0.867g/cm3 (Cal.)
Boiling point 260-265°C (Expl.)
265.393°C at 760 mmHg (Cal.)
Flash point 115.003°C (Cal.)
Refractive index 1.427-1.431 (Expl.)
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