Chemical Properties of Valerenol

Valerenol

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InChI
InChI=1S/C15H24O/c1-10(9-16)8-13-6-4-11(2)14-7-5-12(3)15(13)14/h8,11,13-14,16H,4-7,9H2,1-3H3/b10-8-/t11-,13+,14?/m1/s1
InChI Key
KIQXKOUFPHTUQS-XJYRDZPNSA-N
Formula
C15H24O
SMILES
CC(=CC1CCC(C)C2CCC(C)=C12)CO
Molecular Weight1
220.35
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Physical Properties

Property Value Unit Source
Δf 98.46 kJ/mol Joback Calculated Property
Δfgas -256.11 kJ/mol Joback Calculated Property
Δfus 29.07 kJ/mol Joback Calculated Property
Δvap 67.35 kJ/mol Joback Calculated Property
log10WS -4.14 Crippen Calculated Property
logPoct/wat 3.698 Crippen Calculated Property
McVol 197.760 ml/mol McGowan Calculated Property
Pc 2064.24 kPa Joback Calculated Property
Inp [1655.00; 1729.00]   Show Hide
Inp 1661.00 NIST
Inp 1711.00 NIST
Inp 1655.00 NIST
Inp 1686.00 NIST
Inp 1729.00 NIST
Inp 1655.00 NIST
Tboil 669.56 K Joback Calculated Property
Tc 870.07 K Joback Calculated Property
Tfus 347.47 K Joback Calculated Property
Vc 0.750 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [574.51; 668.78] J/mol×K [669.56; 870.07] Show Hide
Cp,gas 574.51 J/mol×K 669.56 Joback Calculated Property
Cp,gas 592.58 J/mol×K 702.98 Joback Calculated Property
Cp,gas 609.62 J/mol×K 736.40 Joback Calculated Property
Cp,gas 625.71 J/mol×K 769.82 Joback Calculated Property
Cp,gas 640.89 J/mol×K 803.24 Joback Calculated Property
Cp,gas 655.23 J/mol×K 836.66 Joback Calculated Property
Cp,gas 668.78 J/mol×K 870.07 Joback Calculated Property

Similar Compounds

Valerenol (cis). Valerenol (trans). (E)-3-((5R,7R,7aR)-3,7-Dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-5-yl)-2-methylprop-2-en-1-ol. 14-Hydroxy-«delta»-cadinene. Valerenic acid. cis-Valerenyl acetate. trans-Valerenyl acetate. Valerenyl acetate. (E)-Opposita-4(15),7(11)-dien-12-ol. Valerena-4,7(11)-diene. Cadina-1,4-dien-3-ol. 14-Hydroxymuurolene. Methyl valerenate. Valerenic acid, TMS. (R,Z)-2-Methyl-6-(4-methylcyclohexa-1,4-dien-1-yl)hept-2-en-1-ol.

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Sources

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