Chemical Properties of Kessane (CAS 3321-66-2)

Kessane

InChI
InChI=1S/C15H26O/c1-10-5-6-13-12(10)9-11-7-8-15(13,4)16-14(11,2)3/h10-13H,5-9H2,1-4H3
InChI Key
QRVMFXFSGYDNJI-UHFFFAOYSA-N
Formula
C15H26O
SMILES
CC1CCC2C1CC1CCC2(C)OC1(C)C
Molecular Weight1
222.37
CAS
3321-66-2
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Physical Properties

Property Value Unit Source
ω 0.3869 Relay (1.0) Calculated Property
Δf 101.14 kJ/mol Joback Calculated Property
Δfgas -332.24 kJ/mol Relay (1.0) Calculated Property
Δfus 21.31 kJ/mol Joback Calculated Property
Δvap 65.84 kJ/mol Relay (1.0) Calculated Property
IE 8.56 eV Relay (1.0) Calculated Property
log10WS -4.28 Relay (1.0) Calculated Property
logPoct/wat 4.016 Crippen Calculated Property
McVol 195.500 ml/mol McGowan Calculated Property
Pc 2045.61 kPa Joback Calculated Property
Inp 1536.90 NIST
Tboil 540.99 K Relay (1.0) Calculated Property
Tc 787.11 K Relay (1.0) Calculated Property
Tfus 336.06 K Relay (1.0) Calculated Property
Vc 0.727 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [561.58; 692.75] J/mol×K [589.05; 816.69] Show Hide
Cp,gas 561.58 J/mol×K 589.05 Joback Calculated Property
Cp,gas 586.42 J/mol×K 626.99 Joback Calculated Property
Cp,gas 609.68 J/mol×K 664.93 Joback Calculated Property
Cp,gas 631.66 J/mol×K 702.87 Joback Calculated Property
Cp,gas 652.64 J/mol×K 740.81 Joback Calculated Property
Cp,gas 672.91 J/mol×K 778.75 Joback Calculated Property
Cp,gas 692.75 J/mol×K 816.69 Joback Calculated Property

Similar Compounds

Isokessane. cis-4,10-epoxy-Amorphane. (-)-Kessane. Guaioxide. Liguloxide isomer. epi-ligulyl oxide. Liguloxide. Dihydrosesquicineole. Peculiaroxide. Eucalyptol. caryophillan-2,6-«beta»-oxide. m-Cineol. 2H-3,9a-Methano-1-benzoxepin, octahydro-2,2,5a,9-tetramethyl-, [3R-(3«alpha»,5a«alpha»,9«alpha»,9a«alpha»)]-. trans-Dihydroagarofuran. «beta»-Dihydroagarafuran.

Find more compounds similar to Kessane.

Sources

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