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Home >> Chemical Listing >> Page 2237 >> 3,4,5-Trimethylbicyclo[4.2.0]octa-1,3,5-trien-7-one

3,4,5-Trimethylbicyclo[4.2.0]octa-1,3,5-trien-7-one
[CAS# 681477-83-8]

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Identification
Name 3,4,5-Trimethylbicyclo[4.2.0]octa-1,3,5-trien-7-one
Synonyms 3,4,5-trimethylbicyclo[4.2.0]octa-1,3,5-trien-7-one; ZINC03847810
Molecular Structure CAS#: 681477-83-8, 3,4,5-Trimethylbicyclo[4.2.0]octa-1,3,5-trien-7-one
Molecular Formula C11H12O
Molecular Weight 160.21
CAS Registry Number 681477-83-8
SMILES O=C2c1c(c(c(cc1C2)C)C)C
InChI 1S/C11H12O/c1-6-4-9-5-10(12)11(9)8(3)7(6)2/h4H,5H2,1-3H3
InChIKey OXZOECWNPLRVGG-UHFFFAOYSA-N
Properties
Density 1.097g/cm3 (Cal.)
Melting point 102-103°C (Expl.)
Boiling point 306.492°C at 760 mmHg (Cal.)
Flash point 131.914°C (Cal.)
Refractive index 1.577 (Cal.)
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