Chemical Properties of 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid (CAS 19250-17-0)

6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid

InChI
InChI=1S/C10H14O2/c1-10(2)6-3-4-7(9(11)12)8(10)5-6/h4,6,8H,3,5H2,1-2H3,(H,11,12)
InChI Key
XPHVDOXZJRTIMV-UHFFFAOYSA-N
Formula
C10H14O2
SMILES
CC1(C)C2CC=C(C(=O)O)C1C2
Molecular Weight1
166.22
CAS
19250-17-0
Other Names
  • Myrtenoic acid
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Physical Properties

Property Value Unit Source
ω 0.5670 Relay (1.0) Calculated Property
ΔfG° -115.89 kJ/mol Joback Calculated Property
ΔfH°gas -377.09 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.12 kJ/mol Joback Calculated Property
ΔvapH° 85.34 kJ/mol Relay (1.0) Calculated Property
IE 9.18 eV Relay (1.0) Calculated Property
log10WS -2.48 Relay (1.0) Calculated Property
logPoct/wat 2.063 Crippen Calculated Property
McVol 133.180 ml/mol McGowan Calculated Property
Pc 3439.94 kPa Joback Calculated Property
Inp 1359.00 NIST
Tboil 524.93 K Relay (1.0) Calculated Property
Tc 790.80 K Relay (1.0) Calculated Property
Tfus 449.54 K Relay (1.0) Calculated Property
Vc 0.428 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [354.13; 421.81] J/mol×K [591.71; 796.05] Show Hide
Cp,gas 354.13 J/mol×K 591.71 Joback Calculated Property
Cp,gas 366.94 J/mol×K 625.77 Joback Calculated Property
Cp,gas 378.97 J/mol×K 659.82 Joback Calculated Property
Cp,gas 390.35 J/mol×K 693.88 Joback Calculated Property
Cp,gas 401.20 J/mol×K 727.93 Joback Calculated Property
Cp,gas 411.64 J/mol×K 761.99 Joback Calculated Property
Cp,gas 421.81 J/mol×K 796.05 Joback Calculated Property

Similar Compounds

Cedren-15-oic acid. Methylmyrtenate. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, (1S)-. (-)-Myrtenol. (1R ,1'R )-1-(6,6-dimethyl-bicyclo[3.1.1]hept-2-en- 2-yl)-1-hydroxy-2-propanone, R. (1S ,1'R )-1-(6,6-dimethyl-bicyclo[3.1.1]hept-2-en- 2-yl)-1-hydroxy-2-propanone (S). Ylangenol. Tricyclo[4.4.0.0(2,7)]dec-3-ene-3-methanol, 1-methyl-8-(1-methylethyl)-. Myrtenyl angelate. (1R)-(-)-Myrtenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-, (1S)-. Methyl (E)-trans-«alpha»-bergamota-2,10-dien-12-oate. Myrtenyl formate.

Find more compounds similar to 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid.

Sources

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