Chemical Properties of 2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione (CAS 41654-27-7)

2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione

InChI
InChI=1S/C10H14O3/c1-6-8(13-4)7(11)5-10(2,3)9(6)12/h5H2,1-4H3
InChI Key
ATEVRAIEOLFIJD-UHFFFAOYSA-N
Formula
C10H14O3
SMILES
COC1=C(C)C(=O)C(C)(C)CC1=O
Molecular Weight1
182.22
CAS
41654-27-7
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Physical Properties

Property Value Unit Source
ΔfusH° 7.85 kJ/mol Joback Calculated Property
logPoct/wat 1.475 Crippen Calculated Property
McVol 145.610 ml/mol McGowan Calculated Property
Inp [1252.00; 1252.00]   Show Hide
Inp 1252.00 NIST
Inp 1252.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [374.71; 462.48] J/mol×K [615.17; 853.35] Show Hide
Cp,gas 374.71 J/mol×K 615.17 Joback Calculated Property
Cp,gas 390.90 J/mol×K 654.87 Joback Calculated Property
Cp,gas 406.43 J/mol×K 694.56 Joback Calculated Property
Cp,gas 421.31 J/mol×K 734.26 Joback Calculated Property
Cp,gas 435.59 J/mol×K 773.95 Joback Calculated Property
Cp,gas 449.30 J/mol×K 813.65 Joback Calculated Property
Cp,gas 462.48 J/mol×K 853.35 Joback Calculated Property

Similar Compounds

2-Cyclohexene-1,4-dione, 2-hydroxy-3,5,5-trimethyl-. Lateriticone. Tasmanone. Cohulupone, TMS. 2-hydroxy-3,5,5-trimethyl-4-methylenecyclohex-2-en-1-one. A-norandrost-3(5)-en-2-one, 3,17-dihydroxy-, diacetate. 6Alpha,21-diacetoxy-11beta,17alpha-dihydroxypregn-4-ene-3,20-dione. 2-HYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE. 6-Acetoxy-11-nor-drim-7-en-9-one. 8-epi-1,2-Dihydroartemisin. GA20-13-O-glucoside, permethylated. GA20-13-O-glucoside, permethyl. cis-Isocohumulone, TMS. 11Beta,17alpha-dihydroxy-2alpha,21-diacetoxypregna-4-ene-3,20-dione. 11Beta,17alpha-dihydroxy-2beta,21-diacetoxypregn-4-ene-3,20-dione.

Find more compounds similar to 2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione.

Sources

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