Chemical Properties of Bornyl propanoate (CAS 78548-53-5)

Bornyl propanoate

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InChI
InChI=1S/C13H22O2/c1-5-11(14)15-10-8-9-6-7-13(10,4)12(9,2)3/h9-10H,5-8H2,1-4H3/t9-,10+,13+/m1/s1
InChI Key
FAFMZORPAAGQFV-NRUUGDAUSA-N
Formula
C13H22O2
SMILES
CCC(=O)OC1CC2CCC1(C)C2(C)C
Molecular Weight1
210.31
CAS
78548-53-5
Other Names
  • endo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl propionate
  • Bornyl propionate
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Physical Properties

Property Value Unit Source
Δf -92.34 kJ/mol Joback Calculated Property
Δfgas -427.21 kJ/mol Joback Calculated Property
Δfus 15.93 kJ/mol Joback Calculated Property
Δvap 50.77 kJ/mol Joback Calculated Property
log10WS -3.30 Crippen Calculated Property
logPoct/wat 3.154 Crippen Calculated Property
McVol 179.750 ml/mol McGowan Calculated Property
Pc 2244.00 kPa Joback Calculated Property
Inp 1362.00 NIST
I [1641.00; 1641.00]   Show Hide
I 1641.00 NIST
I 1641.00 NIST
Tboil 582.02 K Joback Calculated Property
Tc 794.09 K Joback Calculated Property
Tfus 380.11 K Joback Calculated Property
Vc 0.688 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [488.22; 590.26] J/mol×K [582.02; 794.09] Show Hide
Cp,gas 488.22 J/mol×K 582.02 Joback Calculated Property
Cp,gas 507.29 J/mol×K 617.37 Joback Calculated Property
Cp,gas 525.26 J/mol×K 652.71 Joback Calculated Property
Cp,gas 542.34 J/mol×K 688.06 Joback Calculated Property
Cp,gas 558.72 J/mol×K 723.40 Joback Calculated Property
Cp,gas 574.62 J/mol×K 758.75 Joback Calculated Property
Cp,gas 590.26 J/mol×K 794.09 Joback Calculated Property
ΔvapH 55.90 kJ/mol 422.50 NIST

Similar Compounds

Isobornyl propionate. Butanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-. Bornyl butyrate. Bornyl isobutyrate. exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl isobutyrate. Pentanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-. Bornyl hexanoate. Isobornyl caprate. Isobornyl laureate. 6-hydroxy-Isobornyl Isobutyrate. Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1S-endo)-. Isobornyl acetate. Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl, acetate. Bornyl acetate. Acetic acid, 1,7,7-trimethyl-bicyclo[2.2.1]hept-2-yl ester.

Find more compounds similar to Bornyl propanoate.

Sources

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