Chemical Properties of (4aS,10aS)-7-Isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,5,6,9,10,10a-decahydrophenanthrene (CAS 41577-36-0)

(4aS,10aS)-7-Isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,5,6,9,10,10a-decahydrophenanthrene

InChI
InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h13-14,18H,6-12H2,1-5H3/t18-,20+/m1/s1
InChI Key
KEQXEEMBFONZBL-QUCCMNQESA-N
Formula
C20H32
SMILES
CC(C)C1=CC2=C(CC1)C1(C)CCCC(C)(C)C1CC2
Molecular Weight1
272.47
CAS
41577-36-0
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Physical Properties

Property Value Unit Source
ΔfusH° 16.62 kJ/mol Joback Calculated Property
logPoct/wat 6.286 Crippen Calculated Property
McVol 251.480 ml/mol McGowan Calculated Property
Inp [2035.60; 2035.60]   Show Hide
Inp 2035.60 NIST
Inp 2035.60 NIST
I [2489.00; 2489.00]   Show Hide
I 2489.00 NIST
I 2489.00 NIST
I 2489.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [764.74; 908.63] J/mol×K [711.87; 946.21] Show Hide
Cp,gas 764.74 J/mol×K 711.87 Joback Calculated Property
Cp,gas 789.91 J/mol×K 750.93 Joback Calculated Property
Cp,gas 814.18 J/mol×K 789.98 Joback Calculated Property
Cp,gas 837.86 J/mol×K 829.04 Joback Calculated Property
Cp,gas 861.28 J/mol×K 868.09 Joback Calculated Property
Cp,gas 884.76 J/mol×K 907.15 Joback Calculated Property
Cp,gas 908.63 J/mol×K 946.21 Joback Calculated Property

Similar Compounds

(1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,5,6,9,10,10a-decahydrophenanthrene-1-carbaldehyde. 7bH,10bH-Cadina-1(6),4-diene. Calamenen-3,5(10)-diene. 10-«beta»(H)-Cadina-1(6),4-diene. 1-Isopropyl-4,7-dimethyl-1,2,3,4,5,6-hexahydronaphthalene. trans-Cadina-1(6),4-diene. Abieta-8(14),13(15)-diene. (4aS,4bS,10aS)-1,1,4a-Trimethyl-7-(propan-2-ylidene)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene. Zonarene. Epizonarene. Zonarene. «delta»-Selinene. «delta»-Selinene. (-)-Selina-5,7(11)-diene. (+)-Eudesma-5,7(11)-diene.

Find more compounds similar to (4aS,10aS)-7-Isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,5,6,9,10,10a-decahydrophenanthrene.

Sources

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