Chemical Properties of Bicyclo[3.1.1]heptane, 2,6,6-trimethyl- (CAS 473-55-2)

Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-

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InChI
InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3
InChI Key
XOKSLPVRUOBDEW-UHFFFAOYSA-N
Formula
C10H18
SMILES
CC1CCC2CC1C2(C)C
Molecular Weight1
138.25
CAS
473-55-2
Other Names
  • Pinane
  • Dihydropinene
  • 2,6,6-Trimethylbicyclo(3.1.1)heptane
  • 1a,2b,5a-2,6,6-Trimethylbicyclo(3.1.1)heptane
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Physical Properties

Property Value Unit Source
Δcliquid -6332.90 kJ/mol NIST
Δf 121.81 kJ/mol Joback Calculated Property
Δfgas -135.73 kJ/mol Joback Calculated Property
Δfus 11.67 kJ/mol Joback Calculated Property
Δvap 36.08 kJ/mol Joback Calculated Property
log10WS -2.83 Crippen Calculated Property
logPoct/wat 3.079 Crippen Calculated Property
McVol 130.040 ml/mol McGowan Calculated Property
Pc 2729.71 kPa Joback Calculated Property
Inp 1002.00 NIST
I 1129.00 NIST
Tboil [438.00; 441.75] K Show Hide
Tboil 440.90 ± 2.00 K NIST
Tboil 438.00 ± 4.00 K NIST
Tboil 441.75 ± 0.30 K NIST
Tc 642.10 K Joback Calculated Property
Tfus [193.05; 220.00] K Show Hide
Tfus 220.00 ± 1.00 K NIST
Tfus 193.05 ± 0.30 K NIST
Vc 0.497 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [287.02; 389.91] J/mol×K [436.85; 642.10] Show Hide
Cp,gas 287.02 J/mol×K 436.85 Joback Calculated Property
Cp,gas 307.28 J/mol×K 471.06 Joback Calculated Property
Cp,gas 326.14 J/mol×K 505.27 Joback Calculated Property
Cp,gas 343.70 J/mol×K 539.47 Joback Calculated Property
Cp,gas 360.10 J/mol×K 573.68 Joback Calculated Property
Cp,gas 375.46 J/mol×K 607.89 Joback Calculated Property
Cp,gas 389.91 J/mol×K 642.10 Joback Calculated Property
Cp,liquid [231.40; 231.80] J/mol×K [311.00; 313.00] Show Hide
Cp,liquid 231.40 J/mol×K 311.00 NIST
Cp,liquid 231.80 J/mol×K 313.00 NIST

Similar Compounds

(-)-trans-Pinane. Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)-. Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, [1S-(1«alpha»,2«beta»,5«alpha»)]-. Caryophyllane-b. Caryophyllane-a. Caryophyllane. Caryophyllane-d. Caryophyllane-c. 1,1,4a-Trimethyl-7,8a-(«alpha»-methylethano)-tetradecahydro-phenanthrene. Copaane. Cyclobutane, 1,1-dimethyl-2-octyl-. 4«alpha»H,5«alpha»H-Eudesmane. Perhydrophenanthrene, 1B-(3R,7-dimethyloctyl)-2A,4bB,8,8,10aB-pentamethyl. onocerane-II. Decahydro-1,1,4a,5,6-pentamethylnaphthalene.

Find more compounds similar to Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-.

Sources

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