Chemical Properties of 2-Acetylfluorene (CAS 781-73-7)

InChI

InChI=1S/C15H12O/c1-10(16)11-6-7-15-13(8-11)9-12-4-2-3-5-14(12)15/h2-8H,9H2,1H3

InChI Key

IBASEVZORZFIIH-UHFFFAOYSA-N

Formula

C15H12O

SMILES

CC(=O)c1ccc2c(c1)Cc1ccccc1-2

Molecular Weight¹

208.26

CAS

781-73-7

Other Names

• 2-Acetofluorene
• 2-Fluorenyl methyl ketone
• Ethanone, 1-(9H-fluoren-2-yl)-
• Ketone, fluoren-2-yl methyl
• fluoren-2-yl methyl ketone

• ω : Acentric Factor.
• 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).
• 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).
• P_c : Critical Pressure (kPa).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[201.83; 505.56]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-7.42400e+01
Coefficient B			1.26112e+00
Coefficient C			-1.00318e-03
Coefficient D			3.21860e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	201.83	J/mol×K	273.00	Calculated Property
Cp,gas	260.61	J/mol×K	353.78	Calculated Property
Cp,gas	310.76	J/mol×K	434.56	Calculated Property
Cp,gas	353.29	J/mol×K	515.33	Calculated Property
Cp,gas	389.23	J/mol×K	596.11	Calculated Property
Cp,gas	419.58	J/mol×K	676.89	Calculated Property
Cp,gas	445.38	J/mol×K	757.67	Calculated Property
Cp,gas	467.62	J/mol×K	838.44	Calculated Property
Cp,gas	487.35	J/mol×K	919.22	Calculated Property
Cp,gas	505.56	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021562; 0.0007276]	Pa×s	[403.15; 638.79]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-9.08421e+00
Coefficient B			1.18720e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			403.15
Temperature range, max.			638.79
η	0.0021562	Pa×s	403.15	Calculated Property
η	0.0018018	Pa×s	429.33	Calculated Property
η	0.0015370	Pa×s	455.51	Calculated Property
η	0.0013340	Pa×s	481.70	Calculated Property
η	0.0011748	Pa×s	507.88	Calculated Property
η	0.0010476	Pa×s	534.06	Calculated Property
η	0.0009442	Pa×s	560.24	Calculated Property
η	0.0008590	Pa×s	586.43	Calculated Property
η	0.0007878	Pa×s	612.61	Calculated Property
η	0.0007276	Pa×s	638.79	Calculated Property

Similar Compounds

Find more compounds similar to 2-Acetylfluorene.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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