Chemical Properties of 2-((1R,4R)-4-Hydroxy-4-methylcyclohex-2-enyl)propan-2-yl acetate (CAS 121958-61-0)

2-((1R,4R)-4-Hydroxy-4-methylcyclohex-2-enyl)propan-2-yl acetate

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InChI
InChI=1S/C12H20O3/c1-9(13)15-11(2,3)10-5-7-12(4,14)8-6-10/h5,7,10,14H,6,8H2,1-4H3/t10-,12-/m1/s1
InChI Key
WMXMTKFKYOOQOL-ZYHUDNBSSA-N
Formula
C12H20O3
SMILES
CC(=O)OC(C)(C)C1C=CC(C)(O)CC1
Molecular Weight1
212.29
CAS
121958-61-0
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Physical Properties

Property Value Unit Source
Δf -276.53 kJ/mol Joback Calculated Property
Δfgas -589.79 kJ/mol Joback Calculated Property
Δfus 14.13 kJ/mol Joback Calculated Property
Δvap 66.11 kJ/mol Joback Calculated Property
log10WS -2.70 Crippen Calculated Property
logPoct/wat 2.045 Crippen Calculated Property
McVol 178.090 ml/mol McGowan Calculated Property
Pc 2603.08 kPa Joback Calculated Property
Inp 1457.40 NIST
Tboil 653.48 K Joback Calculated Property
Tc 859.50 K Joback Calculated Property
Tfus 388.20 K Joback Calculated Property
Vc 0.655 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [501.08; 584.61] J/mol×K [653.48; 859.50] Show Hide
Cp,gas 501.08 J/mol×K 653.48 Joback Calculated Property
Cp,gas 516.74 J/mol×K 687.82 Joback Calculated Property
Cp,gas 531.56 J/mol×K 722.15 Joback Calculated Property
Cp,gas 545.65 J/mol×K 756.49 Joback Calculated Property
Cp,gas 559.12 J/mol×K 790.82 Joback Calculated Property
Cp,gas 572.07 J/mol×K 825.16 Joback Calculated Property
Cp,gas 584.61 J/mol×K 859.50 Joback Calculated Property

Similar Compounds

1-Methyl-4-(1-acetoxy-1-methylethyl)-cyclohex-2-enol. 2,3-Dehydro-1,8-cineole. cis-p-Menth-2-en-1,8-diol. trans-p-Menth-2-en-1,8-diol. Dehydro-sesquicineole. (1R,3S,4S)-1,3-Dimethyl-3-(4-methylpent-3-en-1-yl)-2-oxabicyclo[2.2.2]oct-5-ene. 3-Acetoxygermacra-1(10),5-dien-4-ol. Menthenyl acetate. Gibberellic acid. Sobrerol 8-acetate. 1,11-Epxoycadina-4,9-diene. m-«alpha»-Terpineol, acetate. trans-Pinen-2-ol. cis-Pinen-3-ol. p-mentha-2,8-dien-1-yl acetate.

Find more compounds similar to 2-((1R,4R)-4-Hydroxy-4-methylcyclohex-2-enyl)propan-2-yl acetate.

Sources

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