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Hexyl 3-Methylbutanoate
[CAS# 10632-13-0]

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Identification
Name Hexyl 3-Methylbutanoate
Synonyms 4-02-00-00899 (Beilstein Handbook Reference); Hexyl 3-methylbutyrate; Hexyl isopentanoate
Molecular Structure CAS#: 10632-13-0, Hexyl 3-Methylbutanoate
Molecular Formula C11H22O2
Molecular Weight 186.29
CAS Registry Number 10632-13-0
SMILES O=C(OCCCCCC)CC(C)C
InChI 1S/C11H22O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h10H,4-9H2,1-3H3
InChIKey RSDDTPVXLMVLQE-UHFFFAOYSA-N
Properties
Density 0.871g/cm3 (Cal.)
Boiling point 215°C (Expl.)
214.151°C at 760 mmHg (Cal.)
Flash point 82.928°C (Cal.)
Refractive index 1.417-1.421 (Expl.)
1.425 (Cal.)
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