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Butyl Neoheptanoate
[CAS# 68039-02-1]

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Identification
Name Butyl Neoheptanoate
Synonyms 4,4-Dimethylpentanoic Acid Butyl Ester; 4,4-Dimethylvaleric Acid Butyl Ester; Butyl Neoheptanoate
Molecular Structure CAS#: 68039-02-1, Butyl Neoheptanoate
Molecular Formula C11H22O2
Molecular Weight 186.29
CAS Registry Number 68039-02-1
EINECS 268-226-4
SMILES C(C(C)(C)C)CC(=O)OCCCC
InChI 1S/C11H22O2/c1-5-6-9-13-10(12)7-8-11(2,3)4/h5-9H2,1-4H3
InChIKey MWIRMYXMMPLBOV-UHFFFAOYSA-N
Properties
Density 0.872g/cm3 (Cal.)
Boiling point 203.178°C at 760 mmHg (Cal.)
Flash point 76.741°C (Cal.)
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