Chemical Properties of Methanone, (2-chlorophenyl)phenyl- (CAS 5162-03-8)

InChI

InChI=1S/C13H9ClO/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-9H

InChI Key

VMHYWKBKHMYRNF-UHFFFAOYSA-N

Formula

C13H9ClO

SMILES

O=C(c1ccccc1)c1ccccc1Cl

Molecular Weight¹

216.66

CAS

5162-03-8

Other Names

• Benzophenone, 2-chloro-
• o-Chlorobenzophenone
• 2-Chlorobenzophenone

• 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_subH° : Enthalpy of sublimation 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).
• 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

Property	Value	Unit	Source
ω	0.4961		Relay (1.0) Calculated Property
ΔfG°	132.92	kJ/mol	Joback Calculated Property
ΔfH°gas	7.66	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.92	kJ/mol	Joback Calculated Property
ΔsubH°	100.20 ± 0.40	kJ/mol	NIST
ΔvapH°	90.31	kJ/mol	Relay (1.0) Calculated Property
IE	[9.60; 9.60]	eV
IE	9.60 ± 0.10	eV	NIST
IE	9.60 ± 0.10	eV	NIST
log10WS	-4.13		Relay (1.0) Calculated Property
logPoct/wat	3.571		Crippen Calculated Property
McVol	160.320	ml/mol	McGowan Calculated Property
Pc	3110.57	kPa	Joback Calculated Property
Inp	[1720.00; 1720.00]
Inp	1720.00		NIST
Inp	1720.00		NIST
Tboil	603.20	K	NIST
Tc	868.50	K	Relay (1.0) Calculated Property
Tfus	319.48	K	Relay (1.0) Calculated Property
Vc	0.582	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[183.63; 447.21]	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			-4.21900e+01
Coefficient B			1.00030e+00
Coefficient C			-6.80460e-04
Coefficient D			1.69560e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	183.63	J/mol×K	273.00	Calculated Property
Cp,gas	234.04	J/mol×K	353.78	Calculated Property
Cp,gas	277.91	J/mol×K	434.56	Calculated Property
Cp,gas	315.79	J/mol×K	515.33	Calculated Property
Cp,gas	348.22	J/mol×K	596.11	Calculated Property
Cp,gas	375.72	J/mol×K	676.89	Calculated Property
Cp,gas	398.83	J/mol×K	757.67	Calculated Property
Cp,gas	418.09	J/mol×K	838.44	Calculated Property
Cp,gas	434.04	J/mol×K	919.22	Calculated Property
Cp,gas	447.21	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016421; 0.0002124]	Pa×s	[381.48; 632.12]	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			-1.15696e+01
Coefficient B			1.96761e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			381.48
Temperature range, max.			632.12
η	0.0016421	Pa×s	381.48	Calculated Property
η	0.0011561	Pa×s	409.33	Calculated Property
η	0.0008511	Pa×s	437.18	Calculated Property
η	0.0006501	Pa×s	465.03	Calculated Property
η	0.0005118	Pa×s	492.87	Calculated Property
η	0.0004134	Pa×s	520.72	Calculated Property
η	0.0003413	Pa×s	548.57	Calculated Property
η	0.0002870	Pa×s	576.42	Calculated Property
η	0.0002452	Pa×s	604.27	Calculated Property
η	0.0002124	Pa×s	632.12	Calculated Property

Similar Compounds

Find more compounds similar to Methanone, (2-chlorophenyl)phenyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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