Chemical Properties of Methanone, (2-amino-5-nitrophenyl)phenyl- (CAS 1775-95-7)

InChI

InChI=1S/C13H10N2O3/c14-12-7-6-10(15(17)18)8-11(12)13(16)9-4-2-1-3-5-9/h1-8H,14H2

InChI Key

PZPZDEIASIKHPY-UHFFFAOYSA-N

Formula

C13H10N2O3

SMILES

Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1

Molecular Weight¹

242.23

CAS

1775-95-7

Other Names

• 2-Amino-5-nitrobenzophenone
• (2-Amino-5-nitrophenyl)phenylmethanone
• 5-Nitro-2-aminobenzophenone
• Benzophenone, 2-amino-5-nitro-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	30.42	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	34.89	kJ/mol	Joback Calculated Property
ΔvapH°	105.75	kJ/mol	Relay (1.0) Calculated Property
IE	8.41	eV	Relay (1.0) Calculated Property
log10WS	-3.52		Relay (1.0) Calculated Property
logPoct/wat	2.408		Crippen Calculated Property
McVol	175.480	ml/mol	McGowan Calculated Property
Pc	3452.08	kPa	Joback Calculated Property
Inp	[2365.00; 2390.00]
Inp	2390.00		NIST
Inp	2390.00		NIST
Inp	2380.00		NIST
Inp	2365.00		NIST
Inp	2365.00		NIST
Inp	2388.00		NIST
Inp	2388.00		NIST
Inp	2365.00		NIST
Tboil	642.61	K	Relay (1.0) Calculated Property
Tc	966.67	K	Relay (1.0) Calculated Property
Tfus	433.85	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[485.16; 534.42]	J/mol×K	[838.60; 1114.50]
Cp,gas	485.16	J/mol×K	838.60	Joback Calculated Property
Cp,gas	495.93	J/mol×K	884.58	Joback Calculated Property
Cp,gas	505.55	J/mol×K	930.57	Joback Calculated Property
Cp,gas	514.11	J/mol×K	976.55	Joback Calculated Property
Cp,gas	521.71	J/mol×K	1022.54	Joback Calculated Property
Cp,gas	528.45	J/mol×K	1068.52	Joback Calculated Property
Cp,gas	534.42	J/mol×K	1114.50	Joback Calculated Property

Similar Compounds

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

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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