Chemical Properties of (1R,3S,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel- (CAS 370557-87-2)

(1R,3S,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-

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InChI
InChI=1S/C12H20O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7-8,10-11H,5-6H2,1-4H3
InChI Key
RYMWIDNPMDLHRP-UHFFFAOYSA-N
Formula
C12H20O2
SMILES
CC(=O)OC1CC2(C(C)C)CC2C1C
Molecular Weight1
196.29
CAS
370557-87-2
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Physical Properties

Property Value Unit Source
Δf -85.61 kJ/mol Joback Calculated Property
Δfgas -420.93 kJ/mol Joback Calculated Property
Δfus 18.21 kJ/mol Joback Calculated Property
Δvap 49.13 kJ/mol Joback Calculated Property
log10WS -2.64 Crippen Calculated Property
logPoct/wat 2.620 Crippen Calculated Property
McVol 165.660 ml/mol McGowan Calculated Property
Pc 2318.07 kPa Joback Calculated Property
Inp [1273.40; 1284.00]   Show Hide
Inp 1273.40 NIST
Inp 1284.00 NIST
Tboil 554.19 K Joback Calculated Property
Tc 758.84 K Joback Calculated Property
Tfus 333.46 K Joback Calculated Property
Vc 0.635 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [438.10; 534.06] J/mol×K [554.19; 758.84] Show Hide
Cp,gas 438.10 J/mol×K 554.19 Joback Calculated Property
Cp,gas 456.42 J/mol×K 588.30 Joback Calculated Property
Cp,gas 473.65 J/mol×K 622.41 Joback Calculated Property
Cp,gas 489.90 J/mol×K 656.52 Joback Calculated Property
Cp,gas 505.31 J/mol×K 690.62 Joback Calculated Property
Cp,gas 519.99 J/mol×K 724.73 Joback Calculated Property
Cp,gas 534.06 J/mol×K 758.84 Joback Calculated Property

Similar Compounds

3-Isothujyl acetate. Thujyl acetate. neo-iso-3-Thujyl acetate. neo-3-thujyl acetate. iso-3-Thujyl acetate. (1R,3R,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel. 24(28)-Dihydrocycloeucalenol acetate. 9,19-Cyclolanostan-3-ol, acetate, (3«beta»)-. 31-Norcycloartanol acetate. 24-Methylcycloartanol acetate. 24-Methyl-31-nor-23-dehydrocycloartanol acetate. 5«alpha»-Cholestan-3«alpha»-ol, 4«alpha»-methyl-, acetate. exo-Pinocampheol, acetate. endo-Pinocampheol, acetate. Pinocampheyl acetate.

Find more compounds similar to (1R,3S,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-.

Sources

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