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3-Isobutoxy-2-cyclohepten-1-one
[CAS# 99196-24-4]

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Identification
Name 3-Isobutoxy-2-cyclohepten-1-one
Synonyms 3-isobutoxycyclohept-2-enone
Molecular Structure CAS#: 99196-24-4, 3-Isobutoxy-2-cyclohepten-1-one
Molecular Formula C11H18O2
Molecular Weight 182.26
CAS Registry Number 99196-24-4
SMILES CC(C)CO\C1=C\C(=O)CCCC1
InChI 1S/C11H18O2/c1-9(2)8-13-11-6-4-3-5-10(12)7-11/h7,9H,3-6,8H2,1-2H3
InChIKey WRMJZTZUWYMLMD-UHFFFAOYSA-N
Properties
Density 0.965g/cm3 (Cal.)
Boiling point 292.298°C at 760 mmHg (Cal.)
Flash point 123.416°C (Cal.)
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