Chemical Properties of E-Isocroweacin (CAS 194609-21-7)

InChI

InChI=1S/C11H12O3/c1-3-4-8-5-6-9-11(10(8)12-2)14-7-13-9/h3-6H,7H2,1-2H3/b4-3+

InChI Key

KLOOULZVSJNLAD-ONEGZZNKSA-N

Formula

C11H12O3

SMILES

CC=Cc1ccc2c(c1OC)OCO2

Molecular Weight¹

192.21

CAS

194609-21-7

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.19; 418.39]	J/mol×K	[584.59; 810.09]
Cp,gas	350.19	J/mol×K	584.59	Joback Calculated Property
Cp,gas	363.50	J/mol×K	622.17	Joback Calculated Property
Cp,gas	375.97	J/mol×K	659.76	Joback Calculated Property
Cp,gas	387.63	J/mol×K	697.34	Joback Calculated Property
Cp,gas	398.55	J/mol×K	734.92	Joback Calculated Property
Cp,gas	408.79	J/mol×K	772.51	Joback Calculated Property
Cp,gas	418.39	J/mol×K	810.09	Joback Calculated Property
η	[0.0002949; 0.0013163]	Pa×s	[370.18; 584.59]
η	0.0013163	Pa×s	370.18	Joback Calculated Property
η	0.0009192	Pa×s	405.91	Joback Calculated Property
η	0.0006803	Pa×s	441.65	Joback Calculated Property
η	0.0005267	Pa×s	477.38	Joback Calculated Property
η	0.0004226	Pa×s	513.12	Joback Calculated Property
η	0.0003489	Pa×s	548.85	Joback Calculated Property
η	0.0002949	Pa×s	584.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to E-Isocroweacin.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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