Chemical Properties of 7-Oxabicyclo[4.1.0]heptan-2-one, 4,4,6-trimethyl- (CAS 10276-21-8)

7-Oxabicyclo[4.1.0]heptan-2-one, 4,4,6-trimethyl-

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InChI
InChI=1S/C9H14O2/c1-8(2)4-6(10)7-9(3,5-8)11-7/h7H,4-5H2,1-3H3
InChI Key
ROTNQFPVXVZSRL-UHFFFAOYSA-N
Formula
C9H14O2
SMILES
CC1(C)CC(=O)C2OC2(C)C1
Molecular Weight1
154.21
CAS
10276-21-8
Other Names
  • Isophorone epoxide
  • Isophorone oxide
  • 2,3-Epoxy-3,5,5-trimethylcyclohexanone
  • 2,3-Epoxy-3,5,5-trimethyl-1-cyclohexanone
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Physical Properties

Property Value Unit Source
Δf -93.10 kJ/mol Joback Calculated Property
Δfgas -349.21 kJ/mol Joback Calculated Property
Δfus 9.20 kJ/mol Joback Calculated Property
Δvap 41.77 kJ/mol Joback Calculated Property
log10WS -1.73 Crippen Calculated Property
logPoct/wat 1.533 Crippen Calculated Property
McVol 123.390 ml/mol McGowan Calculated Property
Pc 3403.91 kPa Joback Calculated Property
Inp [1333.00; 1333.00]   Show Hide
Inp 1333.00 NIST
Inp 1333.00 NIST
Tboil 513.65 K Joback Calculated Property
Tc 748.55 K Joback Calculated Property
Tfus 361.90 K Joback Calculated Property
Vc 0.469 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [309.41; 394.39] J/mol×K [513.65; 748.55] Show Hide
Cp,gas 309.41 J/mol×K 513.65 Joback Calculated Property
Cp,gas 326.04 J/mol×K 552.80 Joback Calculated Property
Cp,gas 341.34 J/mol×K 591.95 Joback Calculated Property
Cp,gas 355.57 J/mol×K 631.10 Joback Calculated Property
Cp,gas 368.98 J/mol×K 670.25 Joback Calculated Property
Cp,gas 381.84 J/mol×K 709.40 Joback Calculated Property
Cp,gas 394.39 J/mol×K 748.55 Joback Calculated Property

Similar Compounds

7-Oxabicyclo[4.1.0]heptan-2-one, 6-methyl-3-(1-methylethyl)-. trans-piperitone oxide. cis-piperitone oxide. cis-carvenone oxide. trans-carvenone oxide. 7-Oxabicyclo[4.1.0]heptan-2-one, 3-methyl-6-(1-methylethyl)-. Chrysanthenone epoxide. Uvidin A. 6-Oxo-isoambroxide. 1-Oxaspiro[2.5]octan-4-one, 2,2,6-trimethyl-, cis-. 1-Oxaspiro[2.5]octan-4-one, 2,2,6-trimethyl-, trans-. (2R,5S)-2,6,10,10-Tetramethyl-1-oxaspiro[4.5]decan-7-one. (1«alpha»,3«beta»,5«beta»,7«alpha»)-3,8,8-trimethyl-4-oxatricyclo[5.1.0.03,5]octane. (1«alpha»,3«alpha»,5«alpha»,7«alpha»)-3,8,8-trimethyl-4-oxatricyclo[5.1.0.03,5]octane. 5Alpha-pregnan-20-one, 16alpha, 17alpha-epoxy-3beta-hydroxy-, acetate.

Find more compounds similar to 7-Oxabicyclo[4.1.0]heptan-2-one, 4,4,6-trimethyl-.

Sources

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