Chemical Properties of Butanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo- (CAS 13109-70-1)

Butanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-

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InChI
InChI=1S/C14H24O2/c1-5-6-12(15)16-11-9-10-7-8-14(11,4)13(10,2)3/h10-11H,5-9H2,1-4H3
InChI Key
VIPNQHBVIDJXJE-UHFFFAOYSA-N
Formula
C14H24O
SMILES
CCCC(=O)OC1CC2CCC1(C)C2(C)C
Molecular Weight1
208.34
CAS
13109-70-1
Other Names
  • Borneol, butyrate
  • Bornyl butanoate
  • Bornyl butyrate
  • Bornyl ester of n-butanoic acid
  • Butyric acid, 2-bornyl ester
  • endo-bornyl butyrate
Sources

Physical Properties

Property Value Unit Source
Δf -83.92 kJ/mol Joback Calculated Property
Δfgas -447.85 kJ/mol Joback Calculated Property
Δfus 18.52 kJ/mol Joback Calculated Property
Δvap 52.99 kJ/mol Joback Calculated Property
logPoct/wat 3.54 Crippen Calculated Property
Pc 2053.03 kPa Joback Calculated Property
Tboil 604.90 K Joback Calculated Property
Tc 813.55 K Joback Calculated Property
Tfus 391.38 K Joback Calculated Property
Vc 0.74 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 539.99 J/mol×K 604.9 Joback Calculated Property
ΔvapH 59.60 kJ/mol 433.5 NIST

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 4
-CH2- 2
>C< (ring) 2
>C=O (nonring) 1
>CH- (ring) 2
-CH2- (ring) 3

Similar Compounds

Bornyl butyrate. Bornyl isovalerate. Isobornyl isovalerate. Butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, exo-. Pentanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-. Isobornyl propionate. Bornyl propanoate. Bornyl hexanoate. Isobornyl caprate. Isobornyl laureate. Butanoic acid, 2-methyl, bornyl ester. isobornyl2-methylbutanoate. Bornyl 2-methylbutanoate. Bornyl isobutyrate. 6-hydroxy-Isobornyl Isobutyrate.

Find more compounds similar to Butanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-.

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