Chemical Properties of Tribromomethyl radical (CAS 4471-18-5)

InChI

InChI=1S/CBr3/c2-1(3)4

InChI Key

ROWMQJJMCWDJDT-UHFFFAOYSA-N

Formula

CBr3

SMILES

Br[C](Br)Br

Molecular Weight¹

251.72

CAS

4471-18-5

• EA : Electron affinity (eV).
• Δ_fH°_{(+) ion} : Enthalpy of formation of positive ion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
EA	[1.73; 2.57]	eV
EA	2.57 ± 0.12	eV	NIST
EA	1.73 ± 0.18	eV	NIST
ΔfH°(+) ion	967.00	kJ/mol	NIST
IE	7.50 ± 0.20	eV	NIST
logPoct/wat	2.618		Crippen Calculated Property
McVol	75.300	ml/mol	McGowan Calculated Property
Tboil	384.12	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Similar Compounds

Find more compounds similar to Tribromomethyl radical.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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