Chemical Properties of 4-epi-Abietal

4-epi-Abietal

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InChI
InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h7,12-14,17-18H,5-6,8-11H2,1-4H3/t17?,18?,19-,20?/m0/s1
InChI Key
HOFSYSONRIGEAC-LWCMGDNJSA-N
Formula
C20H30O
SMILES
CC(C)C1=CC2=CCC3C(C)(C=O)CCCC3(C)C2CC1
Molecular Weight1
286.45
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Physical Properties

Property Value Unit Source
Δf 159.28 kJ/mol Joback Calculated Property
Δfgas -256.63 kJ/mol Joback Calculated Property
Δfus 20.37 kJ/mol Joback Calculated Property
Δvap 66.34 kJ/mol Joback Calculated Property
log10WS -5.66 Crippen Calculated Property
logPoct/wat 5.321 Crippen Calculated Property
McVol 253.050 ml/mol McGowan Calculated Property
Pc 1676.91 kPa Joback Calculated Property
Inp [2268.00; 2299.00]   Show Hide
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp 2288.00 NIST
Inp Outlier 2268.00 NIST
Inp 2299.00 NIST
Inp 2288.00 NIST
Tboil 750.88 K Joback Calculated Property
Tc 985.34 K Joback Calculated Property
Tfus 448.50 K Joback Calculated Property
Vc 0.965 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [793.64; 933.99] J/mol×K [750.88; 985.34] Show Hide
Cp,gas 793.64 J/mol×K 750.88 Joback Calculated Property
Cp,gas 817.55 J/mol×K 789.96 Joback Calculated Property
Cp,gas 840.83 J/mol×K 829.03 Joback Calculated Property
Cp,gas 863.79 J/mol×K 868.11 Joback Calculated Property
Cp,gas 886.76 J/mol×K 907.19 Joback Calculated Property
Cp,gas 910.05 J/mol×K 946.26 Joback Calculated Property
Cp,gas 933.99 J/mol×K 985.34 Joback Calculated Property

Similar Compounds

Abietal. (1R,4aR,4bS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,4b,5,9,10,10a-decahydrophenanthrene-1-carbaldehyde. Abieta-7,13-dien-3-one. (1R,4aR,4bS,10aR)-1,4a-Dimethyl-7-(propan-2-ylidene)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-1-carbaldehyde. Abietadiene. (1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,5,6,9,10,10a-decahydrophenanthrene-1-carbaldehyde. Abietic acid. (4aS,4bS,10aS)-7-Isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,4b,5,9,10,10a-decahydrophenanthrene. Methyl abietate. Methyl abieta-7,13-dien-18-oate. Dehydroabietene. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl 8(14),12-Abietadien-18-oate. Isopimarinal. Abietic acid, trimethylsilyl ester.

Find more compounds similar to 4-epi-Abietal.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.