Chemical Properties of 5,5'-Bitetrazole (CAS 2783-98-4)

InChI

InChI=1S/C2H2N8/c3-1(4-8-7-3)2-5-9-10-6-2/h(H,3,4,7,8)(H,5,6,9,10)

InChI Key

MTAYYBKXNAEQOK-UHFFFAOYSA-N

Formula

C2H2N8

SMILES

n1n[nH]c(-c2nnn[nH]2)n1

Molecular Weight¹

138.09

CAS

2783-98-4

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	-1604.60 ± 0.96	kJ/mol	NIST
ΔfH°solid	[531.70; 531.70]	kJ/mol
ΔfH°solid	531.70 ± 0.96	kJ/mol	NIST
ΔfH°solid	531.70	kJ/mol	NIST
log10WS	-1.11		Crippen Calculated Property
logPoct/wat	-2.584		Crippen Calculated Property
McVol	79.960	ml/mol	McGowan Calculated Property

Similar Compounds

Find more compounds similar to 5,5'-Bitetrazole.

Sources

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

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