Chemical Properties of 2,4,6-Trichloroborazine (CAS 933-18-6)

InChI

InChI=1S/B3Cl3H3N3/c4-1-7-2(5)9-3(6)8-1/h7-9H

InChI Key

IJXPQKHXJCOFGH-UHFFFAOYSA-N

Formula

B3Cl3H3N3

SMILES

ClB1NB(Cl)NB(Cl)N1

Molecular Weight¹

183.84

CAS

933-18-6

Other Names

• Borazine, 2,4,6-trichloro-

• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	[10.55; 10.55]	eV
IE	10.55	eV	NIST
IE	10.55	eV	NIST
log10WS	4.51		Crippen Calculated Property
logPoct/wat	-0.560		Crippen Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
ΔsubH	[70.50; 71.10]	kJ/mol	[328.00; 335.00]
ΔsubH	70.50 ± 0.40	kJ/mol	328.00	NIST
ΔsubH	71.10	kJ/mol	335.00	NIST
ΔvapH	[47.80; 49.60]	kJ/mol	[373.00; 386.00]
ΔvapH	47.80	kJ/mol	373.00	NIST
ΔvapH	49.60 ± 0.20	kJ/mol	386.00	NIST

Similar Compounds

Find more compounds similar to 2,4,6-Trichloroborazine.

Sources

• Crippen Method
• Crippen Method
• NIST Webbook

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