Chemical Properties of Trifluoromethyl radical (CAS 2264-21-3)

InChI

InChI=1S/CF3/c2-1(3)4

InChI Key

WZKSXHQDXQKIQJ-UHFFFAOYSA-N

Formula

CF3

SMILES

F[C](F)F

Molecular Weight¹

69.01

CAS

2264-21-3

• EA : Electron affinity (eV).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• 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
EA	[1.80; 3.25]	eV
EA	1.82 ± 0.05	eV	NIST
EA	1.90 ± 0.30	eV	NIST
EA	2.82 ± 0.01	eV	NIST
EA	1.87	eV	NIST
EA	1.80 ± 0.20	eV	NIST
EA	2.00	eV	NIST
EA	2.80 ± 0.20	eV	NIST
EA	2.20	eV	NIST
EA	2.20 ± 0.30	eV	NIST
EA	2.40 ± 0.50	eV	NIST
EA	2.05 ± 0.20	eV	NIST
EA	3.15 ± 0.20	eV	NIST
EA	2.50	eV	NIST
EA	2.70 ± 0.20	eV	NIST
EA	2.10 ± 0.30	eV	NIST
EA	2.60	eV	NIST
EA	Outlier 3.25	eV	NIST
EA	1.97 ± 0.23	eV	NIST
ΔfH°gas	-429.00 ± 13.00	kJ/mol	NIST
IE	[8.50; 10.60]	eV
IE	8.76	eV	NIST
IE	Outlier 10.60	eV	NIST
IE	8.50 ± 0.80	eV	NIST
IE	8.60 ± 0.07	eV	NIST
IE	9.30 ± 0.20	eV	NIST
IE	8.90	eV	NIST
IE	9.14	eV	NIST
IE	9.17	eV	NIST
IE	9.50	eV	NIST
IE	9.11	eV	NIST
IE	9.80 ± 0.20	eV	NIST
IE	9.25 ± 0.04	eV	NIST
log10WS	-0.90		Crippen Calculated Property
logPoct/wat	1.342		Crippen Calculated Property
McVol	28.110	ml/mol	McGowan Calculated Property

Similar Compounds

Find more compounds similar to Trifluoromethyl radical.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.