Chemical Properties of Methanone, (2-amino-5-nitrophenyl)(2-chlorophenyl)- (CAS 2011-66-7)

InChI

InChI=1S/C13H9ClN2O3/c14-11-4-2-1-3-9(11)13(17)10-7-8(16(18)19)5-6-12(10)15/h1-7H,15H2

InChI Key

GRDGBWVSVMLKBV-UHFFFAOYSA-N

Formula

C13H9ClN2O3

SMILES

Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1Cl

Molecular Weight¹

276.68

CAS

2011-66-7

Other Names

• 2-Amino-2'-chloro-5-nitrobenzophenone
• 2-Amino-5-nitro-2'-chlorbenzophenone
• 2-Amino-5-nitro-2'-chlorobenzophenone
• Benzophenone, 2-amino-2'-chloro-5-nitro
• Clonazepam, acid hydrolyzed

• 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°	215.66	kJ/mol	Joback Calculated Property
ΔfH°gas	21.71	kJ/mol	Joback Calculated Property
ΔfusH°	38.70	kJ/mol	Joback Calculated Property
ΔvapH°	89.43	kJ/mol	Joback Calculated Property
log10WS	-4.40		Crippen Calculated Property
logPoct/wat	3.061		Crippen Calculated Property
McVol	187.720	ml/mol	McGowan Calculated Property
Pc	3250.43	kPa	Joback Calculated Property
Inp	[2470.00; 2516.00]
Inp	2494.00		NIST
Inp	2470.00		NIST
Inp	2470.00		NIST
Inp	2470.00		NIST
Inp	2470.00		NIST
Inp	Outlier 2516.00		NIST
Inp	2470.00		NIST
Inp	2494.00		NIST
Tboil	880.81	K	Joback Calculated Property
Tc	1158.06	K	Joback Calculated Property
Tfus	633.39	K	Joback Calculated Property
Vc	0.714	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[501.18; 543.47]	J/mol×K	[880.81; 1158.06]
Cp,gas	501.18	J/mol×K	880.81	Joback Calculated Property
Cp,gas	510.60	J/mol×K	927.02	Joback Calculated Property
Cp,gas	518.95	J/mol×K	973.23	Joback Calculated Property
Cp,gas	526.32	J/mol×K	1019.44	Joback Calculated Property
Cp,gas	532.80	J/mol×K	1065.64	Joback Calculated Property
Cp,gas	538.49	J/mol×K	1111.85	Joback Calculated Property
Cp,gas	543.47	J/mol×K	1158.06	Joback Calculated Property

Similar Compounds

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

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.