Chemical Properties of (E)-Sesquithujen-12-ol

(E)-Sesquithujen-12-ol

InChI
InChI=1S/C15H24O/c1-11(10-16)5-4-6-13(3)15-8-7-12(2)14(15)9-15/h5,7,13-14,16H,4,6,8-10H2,1-3H3/b11-5+/t13-,14+,15+/m1/s1
InChI Key
ASCIVPSLEDFVHI-BFONTGBQSA-N
Formula
C15H24O
SMILES
CC(=CCCC(C)C12CC=C(C)C1C2)CO
Molecular Weight1
220.35
Other Names
  • (E)-Sesquithujene-12-ol
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Physical Properties

Property Value Unit Source
ω 0.6046 Relay (1.0) Calculated Property
ΔfG° 144.17 kJ/mol Joback Calculated Property
ΔfH°gas -199.09 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 24.87 kJ/mol Joback Calculated Property
ΔvapH° 93.95 kJ/mol Relay (1.0) Calculated Property
IE 8.14 eV Relay (1.0) Calculated Property
log10WS -3.97 Relay (1.0) Calculated Property
logPoct/wat 3.698 Crippen Calculated Property
McVol 197.760 ml/mol McGowan Calculated Property
Pc 2113.89 kPa Joback Calculated Property
Inp 1665.00 NIST
Tboil 564.15 K Relay (1.0) Calculated Property
Tc 794.25 K Relay (1.0) Calculated Property
Tfus 278.98 K Relay (1.0) Calculated Property
Vc 0.664 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [562.25; 648.74] J/mol×K [656.24; 849.04] Show Hide
Cp,gas 562.25 J/mol×K 656.24 Joback Calculated Property
Cp,gas 578.04 J/mol×K 688.37 Joback Calculated Property
Cp,gas 593.09 J/mol×K 720.51 Joback Calculated Property
Cp,gas 607.55 J/mol×K 752.64 Joback Calculated Property
Cp,gas 621.55 J/mol×K 784.78 Joback Calculated Property
Cp,gas 635.23 J/mol×K 816.91 Joback Calculated Property
Cp,gas 648.74 J/mol×K 849.04 Joback Calculated Property

Similar Compounds

Thujen-3-en-10-ol. (Z)-Bergamotol acetate. trans-«alpha»-Bergamotol. Bergamotol, Z-«alpha»-trans-. (E)-trans-Bergamota-2,12-dien-14-ol. «alpha»-Bergamotol. Bergamotol. (Z)-trans-Bergamotol. (1R,5R)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene. (1S,5S)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene. 7-epi-Sesquithujene. Cubebene. 6-epi-«alpha»-Cubebene. «alpha»-Cubebene. Tricyclo[4.4.0.0(2,7)]dec-3-ene-3-methanol, 1-methyl-8-(1-methylethyl)-.

Find more compounds similar to (E)-Sesquithujen-12-ol.

Sources

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