Chemical Properties of (.+/-.)-Demethylsalvicanol (CAS 177019-45-3)

(.+/-.)-Demethylsalvicanol

InChI
InChI=1S/C20H30O3/c1-12(2)14-10-13-6-7-16-19(3,4)8-5-9-20(16,23)11-15(13)18(22)17(14)21/h10,12,16,21-23H,5-9,11H2,1-4H3
InChI Key
XZANDTPHDIYTME-UHFFFAOYSA-N
Formula
C20H30O3
SMILES
CC(C)c1cc2c(c(O)c1O)CC1(O)CCCC(C)(C)C1CC2
Molecular Weight1
318.45
CAS
177019-45-3
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Physical Properties

Property Value Unit Source
ΔfusH° 31.39 kJ/mol Joback Calculated Property
logPoct/wat 4.267 Crippen Calculated Property
McVol 264.790 ml/mol McGowan Calculated Property
Inp [2641.10; 2641.10]   Show Hide
Inp 2641.10 NIST
Inp 2641.10 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [955.17; 1165.71] J/mol×K [968.92; 1210.24] Show Hide
Cp,gas 955.17 J/mol×K 968.92 Joback Calculated Property
Cp,gas 983.28 J/mol×K 1009.14 Joback Calculated Property
Cp,gas 1013.59 J/mol×K 1049.36 Joback Calculated Property
Cp,gas 1046.53 J/mol×K 1089.58 Joback Calculated Property
Cp,gas 1082.56 J/mol×K 1129.80 Joback Calculated Property
Cp,gas 1122.14 J/mol×K 1170.02 Joback Calculated Property
Cp,gas 1165.71 J/mol×K 1210.24 Joback Calculated Property

Similar Compounds

5,6-Dihydrouracil riboside, TMS. azadirachtin. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. ethyl eburnamenine-14-carboxylate. 16A-Hydroxyoestrone, TMS. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. Nicodicodine. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. DIHYDROERGOKRYPTINE. BUPRENORPHINE. 2-Amino-2-phenylethanol, ferrocenylboronate. 6-O,N-Diacetylnorcodeine. Norcodeine. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester).

Find more compounds similar to (.+/-.)-Demethylsalvicanol.

Sources

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