Kamlet-Taft solvent parameters, α (hydrogen bond donor),
β (hydrogen bond acceptor), and π
*
(polarizability).
The values of α have been set to 0 for solvents that are assumed to be unable to donate hydrogen bonds.
This is the main reason it differs from other measures of hydrogen bond acidity, e.g. E
T and AN.
Sometimes a "polarity correction term" (fudge factor), δ, is also used.
For aromatics δ=1.0, for polychlorinated compounds δ=0.5, and for all other solvents δ=0.0 .
α is correlated with
→Dimroth-Reichardt ET
(
→ET vs α) and
→Gutmann AN
(
→AN vs α).
β is correlated with
→Gutmann DN
(
→DN vs β) except for amines and sulfides.
π
* is correlated with
→Catalán SPP
(
→SPP vs π*).
Name | α | β | π* |
---|
1,1,1,3,3,3-hexafluoro-2-propanol | 1.96 | 0.00 | 0.65 |
1,1,1-trichloroethane | 0.00 | 0.00 | 0.49 |
1,1,2,2-tetrachloroethane | 0.00 | 0.00 | 0.95 |
1,1,3,3-tetramethylguanidine | 0.00 | 0.86 | 0.76 |
1,1-dichloroethane | 0.10 | 0.10 | 0.48 |
1,2,3-propanetriol | 1.21 | 0.51 | 0.62 |
1,2-diaminoethane | 0.13 | 1.43 | 0.47 |
1,2-dibromoethane | 0.00 | 0.00 | 0.75 |
1,2-dichlorobenzene | 0.00 | 0.03 | 0.80 |
1,2-dichloroethane | 0.00 | 0.10 | 0.81 |
1,2-dimethoxyethane | 0.00 | 0.41 | 0.53 |
1,3,5-trimethylbenzene | 0.00 | 0.13 | 0.41 |
1,3-dichlorobenzene | 0.00 | 0.03 | 0.75 |
1,3-dimethylbenzene | 0.00 | 0.11 | 0.47 |
1,3-dioxolane | 0.00 | 0.45 | 0.69 |
1,4-difluorobenzene | 0.00 | 0.03 | 0.58 |
1,4-dimethylbenzene | 0.00 | 0.12 | 0.43 |
1-bromobutane | 0.00 | 0.13 | 0.50 |
1-butyl-3-methyl-1H-imidazol-3-ium trifluoromethanesulfonate | 0.63 | 0.46 | 1.01 |
1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide | 0.62 | 0.24 | 0.98 |
1-chlorobutane | 0.00 | 0.00 | 0.39 |
1-ethyl-3-methyl-1H-imidazol-3-ium dicyanoazanide | 0.53 | 0.35 | 1.08 |
1-ethyl-3-methyl-1H-imidazol-3-ium hexafluorophosphate | 0.76 | 0.20 | 0.99 |
1-ethyl-3-methyl-1H-imidazol-3-ium hexyl sulfate | 0.65 | 0.71 | 0.98 |
1-ethyl-3-methyl-1H-imidazol-3-ium octyl sulfate | 0.65 | 0.77 | 0.93 |
1-ethyl-3-methyl-1H-imidazol-3-ium perchlorate | 0.56 | 0.41 | 1.11 |
1-ethyl-3-methylimidazolium acetate | 0.40 | 0.95 | 1.09 |
1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide | 0.76 | 0.28 | 0.90 |
1-ethyl-3-methylimidazolium nitrate | 0.48 | 0.66 | 1.13 |
1-ethyl-3-methylimidazolium tetrafluoroborate | 0.70 | 0.26 | 1.03 |
1-hexyl-3-methyl-1H-imidazol-3-ium bis[(trifluoromethyl)sulfonyl]azanide | 0.65 | 0.25 | 0.98 |
1-iodobutane | 0.00 | 0.23 | 0.47 |
2,2,2-trifluoroethanol | 1.51 | 0.00 | 0.73 |
2,6-dimethylpyridine | 0.00 | 0.76 | 0.80 |
2-bromopyridine | 0.00 | 0.53 | 1.00 |
2-butanol | 0.69 | 0.80 | 0.40 |
2-butanone | 0.06 | 0.48 | 0.67 |
2-chloroaniline | 0.25 | 0.40 | 0.83 |
2-chloroethanol | 1.28 | 0.53 | 0.46 |
2-cyanopyridine | 0.00 | 0.29 | 1.20 |
2-fluoropyridine | 0.00 | 0.51 | 0.84 |
2-heptanone | 0.05 | 0.48 | 0.61 |
2-methyl-1-propanol | 0.79 | 0.84 | 0.40 |
2-methyl-2-butanol | 0.28 | 0.93 | 0.40 |
2-methyl-2-propanol | 0.42 | 0.93 | 0.41 |
2-methylbutane | 0.00 | 0.01 | -0.08 |
2-pentanone | 0.00 | 0.52 | 0.65 |
2-phenylacetonitrile | 0.00 | 0.41 | 1.00 |
2-phenylethanol | 0.64 | 0.61 | 0.88 |
2-propanol | 0.76 | 0.84 | 0.48 |
2-propanone | 0.08 | 0.43 | 0.71 |
2-propen-1-ol | 0.84 | 0.90 | 0.52 |
2-pyrrolidone | 0.36 | 0.77 | 0.85 |
3,4-dimethylpyridine | 0.00 | 0.78 | 0.73 |
3-bromopyridine | 0.00 | 0.60 | 0.89 |
3-chlorophenol | 1.57 | 0.23 | 0.77 |
3-methyl-1-butanol | 0.84 | 0.86 | 0.40 |
3-methyl-1-octyl-1H-imidazol-3-ium bis[(trifluoromethyl)sulfonyl]azanide | 0.97 | 0.28 | 0.97 |
3-methylphenol | 1.13 | 0.34 | 0.68 |
3-pentanone | 0.00 | 0.45 | 0.72 |
3-phenylpropanol | 0.53 | 0.55 | 0.95 |
4-methyl-2-oxo-1,3-dioxolane | 0.00 | 0.40 | 0.83 |
4-methyl-2-pentanone | 0.02 | 0.48 | 0.65 |
4-methylphenol | 1.64 | 0.34 | 0.68 |
4-methylpyridine | 0.00 | 0.67 | 0.84 |
acetic acid | 1.12 | 0.45 | 0.64 |
acetic anhydride | 0.00 | 0.29 | 0.76 |
acetonitrile | 0.19 | 0.40 | 0.75 |
acetophenone | 0.04 | 0.49 | 0.90 |
aniline | 0.26 | 0.50 | 0.73 |
benzene | 0.00 | 0.10 | 0.59 |
benzonitrile | 0.00 | 0.37 | 0.90 |
benzyl alcohol | 0.60 | 0.52 | 0.98 |
bis(2-chloroethyl) ether | 0.00 | 0.40 | 0.82 |
bis(2-methoxyethyl) ether | 0.00 | 0.40 | 0.64 |
bromobenzene | 0.00 | 0.06 | 0.79 |
butanamine | 0.00 | 0.72 | 0.31 |
butanenitrile | 0.00 | 0.40 | 0.71 |
butanoic acid | 1.10 | 0.45 | 0.56 |
butanol | 0.84 | 0.84 | 0.47 |
butyl acetate | 0.00 | 0.45 | 0.46 |
carbon disulfide | 0.00 | 0.07 | 0.61 |
chloroacetonitrile | 0.00 | 0.34 | 1.01 |
chlorobenzene | 0.00 | 0.07 | 0.71 |
cis-decalin | 0.00 | 0.08 | 0.11 |
cyclohexane | 0.00 | 0.00 | 0.00 |
cyclohexanol | 0.66 | 0.84 | 0.45 |
cyclohexanone | 0.00 | 0.53 | 0.76 |
cyclopentanone | 0.00 | 0.52 | 0.76 |
decane | 0.00 | 0.00 | 0.03 |
decanol | 0.70 | 0.82 | 0.45 |
di-n-butyl sulfide | 0.00 | 0.38 | 0.36 |
dibenzyl ether | 0.00 | 0.41 | 0.80 |
dibromomethane | 0.00 | 0.00 | 0.92 |
dibutyl ether | 0.00 | 0.46 | 0.27 |
dichloromethane | 0.13 | 0.10 | 0.82 |
diethyl carbonate | 0.00 | 0.40 | 0.45 |
diethyl ether | 0.00 | 0.47 | 0.27 |
diethyl sulfide | 0.00 | 0.37 | 0.46 |
diethylamine | 0.30 | 0.70 | 0.24 |
diiodomethane | 0.00 | 0.00 | 0.65 |
diisopropyl ether | 0.00 | 0.49 | 0.27 |
diisopropyl sulfide | 0.00 | 0.38 | 0.36 |
dimethyl phthalate | 0.00 | 0.78 | 0.82 |
dimethyl sulfide | 0.00 | 0.34 | 0.57 |
dimethyl sulfoxide | 0.00 | 0.76 | 1.00 |
dimethylcyanamide | 0.00 | 0.64 | 0.72 |
dioxane | 0.00 | 0.37 | 0.55 |
diphenyl ether | 0.00 | 0.13 | 0.66 |
dipropyl ether | 0.00 | 0.46 | 0.27 |
dodecane | 0.00 | 0.00 | 0.05 |
ethanediol | 0.90 | 0.52 | 0.92 |
ethanol | 0.86 | 0.75 | 0.54 |
ethoxybenzene | 0.00 | 0.30 | 0.69 |
ethyl acetate | 0.00 | 0.45 | 0.55 |
ethyl benzoate | 0.00 | 0.41 | 0.74 |
ethyl chloroacetate | 0.00 | 0.35 | 0.70 |
ethyl formate | 0.00 | 0.36 | 0.61 |
ethyl trichloroacetate | 0.00 | 0.25 | 0.61 |
fluorobenzene | 0.00 | 0.07 | 0.62 |
formamide | 0.71 | 0.48 | 0.97 |
formic acid | 1.23 | 0.38 | 0.65 |
heptane | 0.00 | 0.00 | -0.08 |
heptanoic acid | 1.20 | 0.45 | 0.50 |
hexafluorobenzene | 0.00 | 0.02 | 0.33 |
hexamethylphosphoramide | 0.00 | 1.05 | 0.87 |
hexane | 0.00 | 0.00 | -0.04 |
hexanoic acid | 1.22 | 0.45 | 0.52 |
hexanol | 0.80 | 0.84 | 0.40 |
iodobenzene | 0.00 | 0.06 | 0.81 |
methanol | 0.98 | 0.66 | 0.60 |
methoxybenzene | 0.00 | 0.32 | 0.73 |
methyl acetate | 0.00 | 0.42 | 0.60 |
methyl formate | 0.00 | 0.37 | 0.62 |
morpholine | 0.29 | 0.70 | 0.39 |
N,N,N',N'-tetramethylurea | 0.00 | 0.80 | 0.83 |
N,N-diethylacetamide | 0.00 | 0.78 | 0.84 |
N,N-dimethylacetamide | 0.00 | 0.76 | 0.88 |
N,N-dimethylaniline | 0.00 | 0.43 | 0.73 |
N,N-dimethylbenzylamine | 0.00 | 0.64 | 0.45 |
N,N-dimethylcyclohexylamine | 0.00 | 0.84 | 0.23 |
N,N-dimethylformamide | 0.00 | 0.69 | 0.88 |
N-methylacetamide | 0.47 | 0.80 | 1.01 |
N-methylaniline | 0.17 | 0.47 | 0.82 |
N-methylformamide | 0.62 | 0.80 | 0.90 |
N-methylpyrrolidone | 0.00 | 0.77 | 0.92 |
nitrobenzene | 0.00 | 0.30 | 1.01 |
nitromethane | 0.22 | 0.06 | 0.85 |
octadecafluoronaphthalene | 0.00 | -0.05 | -0.32 |
octane | 0.00 | 0.00 | 0.01 |
octanol | 0.77 | 0.81 | 0.40 |
oxane | 0.00 | 0.54 | 0.51 |
oxolan-2-one | 0.00 | 0.49 | 0.87 |
pentafluoropyridine | 0.00 | 0.16 | 0.53 |
pentane | 0.00 | 0.00 | -0.08 |
pentanoic acid | 1.19 | 0.45 | 0.54 |
pentanol | 0.84 | 0.86 | 0.40 |
perfluoro(methylcyclohexane) | 0.00 | -0.06 | -0.40 |
phenol | 1.65 | 0.30 | 0.72 |
piperidine | 0.00 | 1.04 | 0.30 |
propanenitrile | 0.00 | 0.39 | 0.71 |
propanoic acid | 1.12 | 0.45 | 0.58 |
propanol | 0.84 | 0.90 | 0.52 |
pyridine | 0.00 | 0.64 | 0.87 |
pyrrolidine | 0.16 | 0.70 | 0.39 |
quinoline | 0.00 | 0.64 | 0.92 |
sulfolane | 0.00 | 0.39 | 0.98 |
tetrachloroethene | 0.00 | 0.05 | 0.28 |
tetrachloromethane | 0.00 | 0.10 | 0.28 |
tetradecafluorohexane | 0.00 | -0.08 | -0.41 |
tetrahydrofuran | 0.00 | 0.55 | 0.58 |
tetramethylsilane | 0.00 | 0.02 | -0.09 |
thiane | 0.00 | 0.36 | 0.61 |
thiolane | 0.00 | 0.44 | 0.62 |
thiolane-1-oxide | 0.00 | 0.81 | 1.06 |
toluene | 0.00 | 0.11 | 0.54 |
trans-1,2-dichloroethene | 0.00 | 0.00 | 0.44 |
tribromomethane | 0.05 | 0.05 | 0.62 |
tributyl phosphate | 0.00 | 0.80 | 0.65 |
tributylamine | 0.00 | 0.62 | 0.16 |
trichloroethene | 0.00 | 0.05 | 0.53 |
trichloromethane | 0.20 | 0.10 | 0.58 |
triethyl phosphate | 0.00 | 0.77 | 0.72 |
triethylamine | 0.00 | 0.71 | 0.14 |
trimethyl phosphate | 0.00 | 0.77 | 0.72 |
water | 1.17 | 0.47 | 1.09 |
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