Chemical Properties of Ethanone, 1-[4-(1-methylethyl)phenyl]- (CAS 645-13-6)

InChI

InChI=1S/C11H14O/c1-8(2)10-4-6-11(7-5-10)9(3)12/h4-8H,1-3H3

InChI Key

PDLCCNYKIIUWHA-UHFFFAOYSA-N

Formula

C11H14O

SMILES

CC(=O)c1ccc(C(C)C)cc1

Molecular Weight¹

162.23

CAS

645-13-6

Other Names

• Acetophenone, 4'-isopropyl-
• p-Isopropylacetophenone
• Cuminone
• 4-Isopropylacetophenone
• 4'-Isopropylacetophenone
• (4-Isopropylphenyl)ethanone
• 1-[4-(1-methylethyl)phenyl]ethan-1-one

• 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	[321.92; 398.64]	J/mol×K	[536.17; 753.50]
Cp,gas	321.92	J/mol×K	536.17	Joback Calculated Property
Cp,gas	336.78	J/mol×K	572.39	Joback Calculated Property
Cp,gas	350.78	J/mol×K	608.61	Joback Calculated Property
Cp,gas	363.93	J/mol×K	644.84	Joback Calculated Property
Cp,gas	376.27	J/mol×K	681.06	Joback Calculated Property
Cp,gas	387.82	J/mol×K	717.28	Joback Calculated Property
Cp,gas	398.64	J/mol×K	753.50	Joback Calculated Property
η	[0.0002227; 0.0029954]	Pa×s	[287.60; 536.17]
η	0.0029954	Pa×s	287.60	Joback Calculated Property
η	0.0014787	Pa×s	329.03	Joback Calculated Property
η	0.0008548	Pa×s	370.46	Joback Calculated Property
η	0.0005518	Pa×s	411.89	Joback Calculated Property
η	0.0003858	Pa×s	453.31	Joback Calculated Property
η	0.0002864	Pa×s	494.74	Joback Calculated Property
η	0.0002227	Pa×s	536.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Ethanone, 1-[4-(1-methylethyl)phenyl]-.

Sources

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

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