Chemical Properties of Methanone, (2-amino-5-chlorophenyl)(2-fluorophenyl)- (CAS 784-38-3)

InChI

InChI=1S/C13H9ClFNO/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15/h1-7H,16H2

InChI Key

GTGMXPIQRQSORU-UHFFFAOYSA-N

Formula

C13H9ClFNO

SMILES

Nc1ccc(Cl)cc1C(=O)c1ccccc1F

Molecular Weight¹

249.67

CAS

784-38-3

Other Names

• 2-Amino-2'-fluoro-5-chlorobenzophenone
• 2-Amino-5-chloro-2'-fluorobenzophenone
• Benzophenone, 2-amino-5-chloro-2'-fluoro-
• 2-amino-5-chlor-2'-fluor-benzophenone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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

Property	Value	Unit	Source
ΔfG°	-14.70	kJ/mol	Joback Calculated Property
ΔfH°gas	-163.64	kJ/mol	Joback Calculated Property
ΔfusH°	30.41	kJ/mol	Joback Calculated Property
ΔvapH°	72.03	kJ/mol	Joback Calculated Property
log10WS	-4.08		Crippen Calculated Property
logPoct/wat	3.292		Crippen Calculated Property
McVol	172.070	ml/mol	McGowan Calculated Property
Pc	3049.04	kPa	Joback Calculated Property
Inp	[2004.00; 2047.00]
Inp	2004.00		NIST
Inp	2047.00		NIST
Inp	2045.00		NIST
Inp	2004.00		NIST
Tboil	728.24	K	Joback Calculated Property
Tc	978.73	K	Joback Calculated Property
Tfus	490.37	K	Joback Calculated Property
Vc	0.649	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[425.65; 480.85]	J/mol×K	[728.24; 978.73]
Cp,gas	425.65	J/mol×K	728.24	Joback Calculated Property
Cp,gas	437.19	J/mol×K	769.99	Joback Calculated Property
Cp,gas	447.71	J/mol×K	811.74	Joback Calculated Property
Cp,gas	457.28	J/mol×K	853.48	Joback Calculated Property
Cp,gas	465.95	J/mol×K	895.23	Joback Calculated Property
Cp,gas	473.79	J/mol×K	936.98	Joback Calculated Property
Cp,gas	480.85	J/mol×K	978.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methanone, (2-amino-5-chlorophenyl)(2-fluorophenyl)-.

Sources

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

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