Chemical Properties of 2,5-Diphenyltetrazole (CAS 18039-45-7)

InChI

InChI=1S/C13H10N4/c1-3-7-11(8-4-1)13-14-16-17(15-13)12-9-5-2-6-10-12/h1-10H

InChI Key

OJPYZWGULWNRSE-UHFFFAOYSA-N

Formula

C13H10N4

SMILES

c1ccc(-c2nnn(-c3ccccc3)n2)cc1

Molecular Weight¹

222.25

CAS

18039-45-7

Other Names

• 2H-Tetrazole, 2,5-diphenyl-
• 2,5-Diphenyl-2H-tetrazole
• 2,5-Diphenyltetrazol

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔsubH	[119.70; 119.70]	kJ/mol	[333.00; 343.00]
ΔsubH	119.70	kJ/mol	333.00	NIST
ΔsubH	119.70 ± 4.20	kJ/mol	343.00	NIST

Similar Compounds

Find more compounds similar to 2,5-Diphenyltetrazole.

Sources

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

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