Chemical Properties of trans-Totarol, methyl ether

trans-Totarol, methyl ether

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InChI
InChI=1S/C21H32O/c1-14(2)19-15-8-11-18-20(3,4)12-7-13-21(18,5)16(15)9-10-17(19)22-6/h9-10,14,18H,7-8,11-13H2,1-6H3/t18?,21-/m1/s1
InChI Key
DORDKDUSCNWFPJ-BDPMCISCSA-N
Formula
C21H32O
SMILES
COc1ccc2c(c1C(C)C)CCC1C(C)(C)CCCC21C
Molecular Weight1
300.48
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Physical Properties

Property Value Unit Source
Δf 180.63 kJ/mol Joback Calculated Property
Δfgas -268.73 kJ/mol Joback Calculated Property
Δfus 21.23 kJ/mol Joback Calculated Property
Δvap 66.18 kJ/mol Joback Calculated Property
log10WS -6.29 Crippen Calculated Property
logPoct/wat 5.849 Crippen Calculated Property
McVol 267.140 ml/mol McGowan Calculated Property
Pc 1490.74 kPa Joback Calculated Property
Inp [2234.00; 2243.00]   Show Hide
Inp 2234.00 NIST
Inp 2243.00 NIST
Inp 2234.00 NIST
Tboil 761.31 K Joback Calculated Property
Tc 991.05 K Joback Calculated Property
Tfus 470.04 K Joback Calculated Property
Vc 1.008 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [830.37; 972.69] J/mol×K [761.31; 991.05] Show Hide
Cp,gas 830.37 J/mol×K 761.31 Joback Calculated Property
Cp,gas 854.48 J/mol×K 799.60 Joback Calculated Property
Cp,gas 878.05 J/mol×K 837.89 Joback Calculated Property
Cp,gas 901.37 J/mol×K 876.18 Joback Calculated Property
Cp,gas 924.73 J/mol×K 914.47 Joback Calculated Property
Cp,gas 948.41 J/mol×K 952.76 Joback Calculated Property
Cp,gas 972.69 J/mol×K 991.05 Joback Calculated Property

Similar Compounds

cis-Totarol, methyl ether. 2-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-1-(1-methylethyl)-, acetate, (4bS-trans)-. 2-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-1-(1-methylethyl)-, (4bS-trans)-. cis-Totarol. 3,13Alpha-dihydroxy-13,17-secoestra-1,3,5(10)-trien-17-oic acid. 3-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-2-(1-methylethyl)-, acetate, (4bs-trans)-. Methoxyoestrone (enol)-TMS. Morphinan, 3-methoxy-. 3-Methoxy-17alpha-oxa-d-homoestra-1,3,5(10)-trien-17-one. Estradiol, HFB. 3,17Beta-dihydroxy-1,3,5(10)estratrien-16beta-ylacetic acid lactone. Estradiol Valerate. 16-Ketoestradiol (enol), TMS. 17«beta»-16-oxo-Oestradiol, TMS. Norlevorphanol.

Find more compounds similar to trans-Totarol, methyl ether.

Sources

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