Chemical Properties of Fragranyl 2-methylbutyrate (CAS 51117-24-9)

Fragranyl 2-methylbutyrate

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InChI
InChI=1S/C15H26O2/c1-6-12(4)14(16)17-10-9-15(5)8-7-13(15)11(2)3/h12-13H,2,6-10H2,1,3-5H3
InChI Key
NRIGIDJZDUBPCH-UHFFFAOYSA-N
Formula
C15H26O2
SMILES
C=C(C)C1CCC1(C)CCOC(=O)C(C)CC
Molecular Weight1
238.37
CAS
51117-24-9
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Physical Properties

Property Value Unit Source
Δf -46.20 kJ/mol Joback Calculated Property
Δfgas -425.83 kJ/mol Joback Calculated Property
Δfus 22.09 kJ/mol Joback Calculated Property
Δvap 55.79 kJ/mol Joback Calculated Property
log10WS -3.99 Crippen Calculated Property
logPoct/wat 3.958 Crippen Calculated Property
McVol 214.490 ml/mol McGowan Calculated Property
Pc 1750.67 kPa Joback Calculated Property
Inp 1574.90 NIST
Tboil 621.59 K Joback Calculated Property
Tc 818.12 K Joback Calculated Property
Tfus 334.33 K Joback Calculated Property
Vc 0.822 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [586.12; 688.30] J/mol×K [621.59; 818.12] Show Hide
Cp,gas 586.12 J/mol×K 621.59 Joback Calculated Property
Cp,gas 605.17 J/mol×K 654.34 Joback Calculated Property
Cp,gas 623.28 J/mol×K 687.10 Joback Calculated Property
Cp,gas 640.55 J/mol×K 719.85 Joback Calculated Property
Cp,gas 657.08 J/mol×K 752.61 Joback Calculated Property
Cp,gas 672.96 J/mol×K 785.36 Joback Calculated Property
Cp,gas 688.30 J/mol×K 818.12 Joback Calculated Property

Similar Compounds

Fragranyl isobutyrate. Fragranyl isovaalerate. Fragranyl propanoate. Fragranyl acetate. (1R,3R)-3-isopropenyl-2,2-dimethylcyclobutylmethyl 3-methyl-3-butenoate. 3-isopropenyl-2,2-dimethylcyclobutanemethyl acetate. 14-Acetoxy-4,5-dihydro- «beta»-caryophyllene. Myrtenyl 2-methyl butyrate. (3R,3aR,4aR,8aS,9aR)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one. 10-epi-Italicen-12-yl 2-methylbutyrate. Italicen-12-yl 2-methylbutyrate. Lavandulyle 2-methylbutyrate. Gibbane-1,10-dicarboxylic acid, 4a-(hydroxymethyl)-1-methyl-8-methylene-, 1,4a-lactone, 10-methyl ester, (1«alpha»,4a«alpha»,4b«beta»,10«beta»)-. [14C] GA15, methyl ester. [14C4]GA15 methyl ester TMS ether.

Find more compounds similar to Fragranyl 2-methylbutyrate.

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