Chemical Properties of (-)-3-Menthoxyacetoxy-(+)-estra-1,3,5(10),6,8-pentaen-17-one

InChI

InChI=1S/C30H38O4/c1-18(2)22-8-5-19(3)15-27(22)33-17-29(32)34-21-7-10-23-20(16-21)6-9-25-24(23)13-14-30(4)26(25)11-12-28(30)31/h6-7,9-10,16,18-19,22,26-27H,5,8,11-15,17H2,1-4H3/t19?,22?,26-,27-,30?/m1/s1

InChI Key

JIPJTPKULQRHGR-BJEUKTRSSA-N

Formula

C30H38O4

SMILES

CC1CCC(C(C)C)C(OCC(=O)Oc2ccc3c4c(ccc3c2)C2CCC(=O)C2(C)CC4)C1

Molecular Weight¹

462.62

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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 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	[1427.79; 1589.65]	J/mol×K	[1140.69; 1401.77]
Cp,gas	1427.79	J/mol×K	1140.69	Joback Calculated Property
Cp,gas	1453.66	J/mol×K	1184.20	Joback Calculated Property
Cp,gas	1479.60	J/mol×K	1227.72	Joback Calculated Property
Cp,gas	1505.88	J/mol×K	1271.23	Joback Calculated Property
Cp,gas	1532.80	J/mol×K	1314.75	Joback Calculated Property
Cp,gas	1560.63	J/mol×K	1358.26	Joback Calculated Property
Cp,gas	1589.65	J/mol×K	1401.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to (-)-3-Menthoxyacetoxy-(+)-estra-1,3,5(10),6,8-pentaen-17-one.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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