Chemical Properties of B-Ionene

B-Ionene

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InChI
InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,9H,1,7-8,10H2,2-4H3/b9-6+
InChI Key
BWPHCNAZKLXPHW-RMKNXTFCSA-N
Formula
C13H20
SMILES
C=CC=CC1=C(C)CCCC1(C)C
Molecular Weight1
176.30
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Physical Properties

Property Value Unit Source
Δf 256.30 kJ/mol Joback Calculated Property
Δfgas 35.40 kJ/mol Joback Calculated Property
Δfus 14.33 kJ/mol Joback Calculated Property
Δvap 44.71 kJ/mol Joback Calculated Property
log10WS -4.48 Crippen Calculated Property
logPoct/wat 4.255 Crippen Calculated Property
McVol 170.270 ml/mol McGowan Calculated Property
Pc 2233.41 kPa Joback Calculated Property
Inp 1483.00 NIST
Tboil 526.59 K Joback Calculated Property
Tc 742.08 K Joback Calculated Property
Tfus 286.51 K Joback Calculated Property
Vc 0.641 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [393.05; 491.40] J/mol×K [526.59; 742.08] Show Hide
Cp,gas 393.05 J/mol×K 526.59 Joback Calculated Property
Cp,gas 411.99 J/mol×K 562.50 Joback Calculated Property
Cp,gas 429.74 J/mol×K 598.42 Joback Calculated Property
Cp,gas 446.43 J/mol×K 634.33 Joback Calculated Property
Cp,gas 462.18 J/mol×K 670.25 Joback Calculated Property
Cp,gas 477.13 J/mol×K 706.16 Joback Calculated Property
Cp,gas 491.40 J/mol×K 742.08 Joback Calculated Property

Similar Compounds

«beta» Carotene. Retinal, 9-cis-. Retinal. Cyclohexene, 2-ethenyl-1,3,3-trimethyl-. 2-Propenal, 3-(2,6,6-trimethyl-1-cyclohexen-1-yl)-. Retinol. 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-. trans-«beta»-Ionone. 1-Penten-3-one, 1-(2,6,6-trimethyl-1-cyclohexen-1-yl)-. «alpha»-Pyrovetivene. Anhydroretinol. Retinoic acid, methyl ester. Allyl ionone. Selina 2,4-diene. 3-Buten-2-one, 4-(2,5,6,6-tetramethyl-1-cyclohexen-1-yl)-.

Find more compounds similar to B-Ionene.

Sources

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