Chemical Properties of 1,1'-Biphenyl, 4,4'-dinitro- (CAS 1528-74-1)

InChI

InChI=1S/C12H8N2O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8H

InChI Key

BDLNCFCZHNKBGI-UHFFFAOYSA-N

Formula

C12H8N2O4

SMILES

O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

Molecular Weight¹

244.20

CAS

1528-74-1

Other Names

• Biphenyl, 4,4'-dinitro-
• 4,4'-Dinitrobiphenyl
• 4,4'-Dinitrodiphenyl
• 4,4'-Dinitrobifenyl

• 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_subH : Enthalpy of sublimation at a given temperature (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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[457.48; 505.17]	J/mol×K	[840.96; 1132.36]
Cp,gas	457.48	J/mol×K	840.96	Joback Calculated Property
Cp,gas	468.03	J/mol×K	889.53	Joback Calculated Property
Cp,gas	477.38	J/mol×K	938.09	Joback Calculated Property
Cp,gas	485.65	J/mol×K	986.66	Joback Calculated Property
Cp,gas	492.96	J/mol×K	1035.23	Joback Calculated Property
Cp,gas	499.43	J/mol×K	1083.80	Joback Calculated Property
Cp,gas	505.17	J/mol×K	1132.36	Joback Calculated Property
ΔsubH	104.60 ± 1.80	kJ/mol	434.50	NIST

Similar Compounds

Find more compounds similar to 1,1'-Biphenyl, 4,4'-dinitro-.

Sources

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

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