ABSTRACT

Compounds not containing carbon Br2 Bromine 1.252 0.944 0.746 Cl3HSi Trichlorosilane 0.415 0.326 Cl3P Phosphorous trichloride 0.870 0.662 0.529 0.439 Cl4Si Tetrachlorosilane 99.4 96.2 H2O Water 1.793 0.890 0.547 0.378 0.282 H4N2 Hydrazine 0.876 0.628 0.480 0.384 Hg Mercury 1.526 1.402 1.312 1.245 NO2 Nitrogen dioxide 0.532 0.402

Compounds containing carbon CCl3F Trichlorofluoromethane 0.740 0.539 0.421 CCl4 Tetrachloromethane 1.321 0.908 0.656 0.494 CS2 Carbon disulfide 0.429 0.352 CHBr3 Tribromomethane 1.857 1.367 1.029 CHCl3 Trichloromethane 0.988 0.706 0.537 0.427 CHN Hydrogen cyanide 0.235 0.183 CH2Br2 Dibromomethane 1.948 1.320 0.980 0.779 0.652 CH2Cl2 Dichloromethane 0.727 0.533 0.413 CH2O2 Formic acid 1.607 1.030 0.724 0.545 CH3I Iodomethane 0.594 0.469 CH3NO Formamide 7.114 3.343 1.833 CH3NO2 Nitromethane 1.311 0.875 0.630 0.481 0.383 0.317 CH4O Methanol 1.258 0.793 0.544 CH5N Methylamine 0.319 0.231 C2Cl3F3 1,1,2-Trichlorotrifluoro-ethane 1.465 0.945 0.656 0.481 C2Cl4 Tetrachloroethylene 1.114 0.844 0.663 0.535 0.442 C2HCl3 Trichloroethylene 0.703 0.545 0.444 0.376 C2HCl5 Pentachloroethane 3.761 2.254 1.491 1.061 C2HF3O2 Trifluoroacetic acid 0.808 0.571 C2H2Cl2 cis-1,2-Dichloroethylene 0.786 0.575 0.445 C2H2Cl2 trans-1,2-Dichloroethylene 0.522 0.398 0.317 0.261 C2H2Cl4 1,1,1,2-Tetrachloroethane 3.660 2.200 1.437 1.006 0.741 0.570 C2H3ClF2 1-Chloro-1,1-difluoro-ethane 0.477 0.376 C2H3ClO Acetyl chloride 0.368 0.294 C2H3Cl3 1,1,1-Trichloroethane 1.847 1.161 0.793 0.578 0.428 C2H3N Acetonitrile 0.400 0.369 0.284 0.234 C2H4Br2 1,2-Dibromoethane 1.595 1.116 0.837 0.661

Molecular formula Name

–25 °C 0 °C 25 °C 50 °C 75 °C 100 °C

C2H4Cl2 1,1-Dichloroethane 0.464 0.362 C2H4Cl2 1,2-Dichloroethane 1.125 0.779 0.576 0.447 C2H4O2 Acetic acid 1.056 0.786 0.599 0.464 C2H4O2 Methyl formate 0.424 0.325 C2H5Br Bromoethane 0.635 0.477 0.374 C2H5Cl Chloroethane 0.416 0.319 C2H5I Iodoethane 0.723 0.556 0.444 0.365 C2H5NO N-Methylformamide 2.549 1.678 1.155 0.824 0.606 C2H5NO2 Nitroethane 1.354 0.940 0.688 0.526 0.415 0.337 C2H6O Ethanol 3.262 1.786 1.074 0.694 0.476 C2H6OS Dimethyl sulfoxide 1.987 1.290 C2H6O2 Ethylene glycol 16.1 6.554 3.340 1.975 C2H6S Dimethyl sulfide 0.356 0.284 C2H6S Ethanethiol 0.364 0.287 C2H7N Dimethylamine 0.300 0.232 C2H7NO Ethanolamine 21.1 8.560 3.935 1.998 C3H5Br 3-Bromopropene 0.620 0.471 0.373 C3H5Cl 3-Chloropropene 0.408 0.314 C3H5ClO Epichlorohydrin 2.492 1.570 1.073 0.781 0.597 0.474 C3H5N Propanenitrile 0.294 0.240 0.202 C3H6O Acetone 0.540 0.395 0.306 0.247 C3H6O Allyl alcohol 1.218 0.759 0.505 C3H6O Propanal 0.321 0.249 C3H6O2 Ethyl formate 0.506 0.380 0.300 C3H6O2 Methyl acetate 0.477 0.364 0.284 C3H6O2 Propanoic acid 1.499 1.030 0.749 0.569 0.449 C3H7Br 1-Bromopropane 0.645 0.489 0.387 C3H7Br 2-Bromopropane 0.612 0.458 0.359 C3H7Cl 1-Chloropropane 0.436 0.334 C3H7Cl 2-Chloropropane 0.401 0.303 C3H7I 1-Iodopropane 0.970 0.703 0.541 0.436 0.363 C3H7I 2-Iodopropane 0.883 0.653 0.506 0.407 C3H7NO N,N-Dimethylformamide 1.176 0.794 0.624 C3H7NO2 1-Nitropropane 1.851 1.160 0.798 0.589 0.460 0.374 C3H8O 1-Propanol 8.645 3.815 1.945 1.107 0.685 C3H8O 2-Propanol 4.619 2.038 1.028 0.576 C3H8O2 1,2-Propylene glycol 248 40.4 11.3 4.770 2.750 C3H8O3 Glycerol 934 152 39.8 14.8 C3H8S 1-Propanethiol 0.503 0.385 C3H8S 2-Propanethiol 0.477 0.357 0.280 C3H9N Propylamine 0.376 C3H9N Isopropylamine 0.454 0.325 C4H4O Furan 0.661 0.475 0.361 C4H5N Pyrrole 2.085 1.225 0.828 0.612 C4H6O3 Acetic anhydride 1.241 0.843 0.614 0.472 0.377 C4H7N Butanenitrile 0.553 0.418 0.330 0.268 C4H8O 2-Butanone 0.720 0.533 0.405 0.315 0.249 C4H8O Tetrahydrofuran 0.849 0.605 0.456 0.359 C4H8O2 1,4-Dioxane 1.177 0.787 0.569 C4H8O2 Ethyl acetate 0.578 0.423 0.325 0.259 C4H8O2 Methyl propionate 0.581 0.431 0.333 0.266 C4H8O2 Propyl formate 0.669 0.485 0.370 0.293 C4H8O2 Butanoic acid 2.215 1.426 0.982 0.714 0.542 C4H8O2 2-Methylpropanoic acid 1.857 1.226 0.863 0.639 0.492 C4H8O2S Sulfolane 6.280 3.818 2.559 C4H8S Tetrahydrothiophene 0.973 0.912 C4H9Br 1-Bromobutane 0.815 0.606 0.471 0.379 C4H9Cl 1-Chlorobutane 0.556 0.422 0.329 0.261 C4H9N Pyrrolidine 1.914 1.071 0.704 0.512 C4H9NO N,N-Dimethylacetamide 1.927

Molecular formula Name

–25 °C 0 °C 25 °C 50 °C 75 °C 100 °C

C4H9NO Morpholine 2.021 1.247 0.850 0.627 C4H10O 1-Butanol 12.19 5.185 2.544 1.394 0.833 0.533 C4H10O 2-Butanol 3.096 1.332 0.698 0.419 C4H10O 2-Methyl-2-propanol 4.312 1.421 0.678 C4H10O Diethyl ether 0.283 0.224 C4H10O3 Diethylene glycol 30.200 11.130 4.917 2.505 C4H10S Diethyl sulfide 0.558 0.422 0.331 0.267 C4H11N Butylamine 0.830 0.574 0.409 0.298 C4H11N Isobutylamine 0.770 0.571 0.367 C4H11N Diethylamine 0.319 0.239 C4H11NO2 Diethanolamine 109.5 28.7 9.100 C5H4O2 Furfural 2.501 1.587 1.143 0.906 0.772 C5H5N Pyridine 1.361 0.879 0.637 0.497 0.409 C5H10 1-Pentene 0.313 0.241 0.195 C5H10 2-Methyl-2-butene 0.255 0.203 C5H10 Cyclopentane 0.555 0.413 0.321 C5H10O Mesityl oxide 1.291 0.838 0.602 0.465 0.381 0.326 C5H10O 2-Pentanone 0.641 0.470 0.362 0.289 0.238 C5H10O 3-Pentanone 0.592 0.444 0.345 0.276 0.227 C5H10O2 Butyl formate 0.937 0.644 0.472 0.362 0.289 C5H10O2 Propyl acetate 0.768 0.544 0.406 0.316 0.255 C5H10O2 Ethyl propanoate 0.691 0.501 0.380 0.299 0.242 C5H10O2 Methyl butanoate 0.759 0.541 0.406 0.318 0.257 C5H10O2 Methyl isobutanoate 0.672 0.488 0.373 0.296 C5H11N Piperidine 1.573 0.958 0.649 0.474 C5H12 Pentane 0.351 0.274 0.224 C5H12 Isopentane 0.376 0.277 0.214 C5H12O 1-Pentanol 25.4 8.512 3.619 1.820 1.035 0.646 C5H12O 2-Pentanol 3.470 1.447 0.761 0.465 C5H12O 3-Pentanol 4.149 1.473 0.727 0.436 C5H12O 2-Methyl-1-butanol 4.453 1.963 1.031 0.612 C5H12O 3-Methyl-1-butanol 8.627 3.692 1.842 1.031 0.631 C5H13N Pentylamine 1.030 0.702 0.493 0.356 C6F6 Hexafluorobenzene 2.789 1.730 1.151 C6H4Cl2 o-Dichlorobenzene 1.958 1.324 0.962 0.739 0.593 C6H4Cl2 m-Dichlorobenzene 1.492 1.044 0.787 0.628 0.525 C6H5Br Bromobenzene 1.560 1.074 0.798 0.627 0.512 C6H5Cl Chlorobenzene 1.703 1.058 0.753 0.575 0.456 0.369 C6H5ClO o-Chlorophenol 3.589 1.835 1.131 0.786 C6H5ClO m-Chlorophenol 4.041 C6H5F Fluorobenzene 0.749 0.550 0.423 0.338 C6H5I Iodobenzene 2.354 1.554 1.117 0.854 0.683 C6H5NO2 Nitrobenzene 3.036 1.863 1.262 0.918 0.704 C6H6 Benzene 0.604 0.436 0.335 C6H6ClN o-Chloroaniline 3.316 1.913 1.248 0.887 C6H6O Phenol 3.437 1.784 1.099 C6H7N Aniline 3.847 2.029 1.247 0.850 C6H8N2 Phenylhydrazine 13.0 4.553 1.850 0.848 C6H10 Cyclohexene 0.882 0.625 0.467 0.364 C6H10O Cyclohexanone 2.017 1.321 0.919 0.671 C6H11N Hexanenitrile 0.912 0.650 0.488 0.382 C6H12 Cyclohexane 0.894 0.615 0.447 C6H12 Methylcyclopentane 0.927 0.653 0.479 0.364 C6H12 1-Hexene 0.441 0.326 0.252 0.202 C6H12O Cyclohexanol 57.5 12.3 4.274 1.982 C6H12O 2-Hexanone 1.300 0.840 0.583 0.429 0.329 0.262 C6H12O 4-Methyl-2-pentanone 0.545 0.406 C6H12O2 Butyl acetate 1.002 0.685 0.500 0.383 0.305 C6H12O2 Isobutyl acetate 0.676 0.493 0.370 0.286 C6H12O2 Ethyl butanoate 0.639 0.453

Molecular formula Name

–25 °C 0 °C 25 °C 50 °C 75 °C 100 °C

C6H12O2 Diacetone alcohol 28.7 6.621 2.798 1.829 1.648 C6H12O3 Paraldehyde 1.079 0.692 0.485 0.362 C6H13N Cyclohexylamine 1.944 1.169 0.782 0.565 C6H14 Hexane 0.405 0.300 0.240 C6H14 2-Methylpentane 0.372 0.286 0.226 C6H14 3-Methylpentane 0.395 0.306 C6H14O Dipropyl ether 0.542 0.396 0.304 0.242 C6H14O 1-Hexanol 4.578 2.271 1.270 0.781 C6H15N Triethylamine 0.455 0.347 0.273 0.221 C6H15N Dipropylamine 0.751 0.517 0.377 0.288 0.228 C6H15N Diisopropylamine 0.393 0.300 0.237 C6H15NO3 Triethanolamine 609 114 31.5 11.7 C7H5N Benzonitrile 1.267 0.883 0.662 0.524 C7H7Cl o-Chlorotoluene 1.390 0.964 0.710 0.547 0.437 C7H7Cl m-Chlorotoluene 1.165 0.823 0.616 0.482 0.391 C7H7Cl p-Chlorotoluene 0.837 0.621 0.483 0.390 C7H8 Toluene 1.165 0.778 0.560 0.424 0.333 0.270 C7H8O o-Cresol 3.035 1.562 0.961 C7H8O m-Cresol 12.9 4.417 2.093 1.207 C7H8O Benzyl alcohol 5.474 2.760 1.618 1.055 C7H8O Anisole 1.056 0.747 0.554 0.427 C7H9N N-Methylaniline 4.120 2.042 1.222 0.825 0.606 C7H9N o-Methyl aniline 10.3 3.823 1.936 1.198 0.839 C7H9N m-Methyl aniline 8.180 3.306 1.679 1.014 0.699 C7H9N Benzylamine 1.624 1.080 0.769 0.577 C7H14 Methylcyclohexane 0.991 0.679 0.501 0.390 0.316 C7H14 1-Heptene 0.441 0.340 0.273 0.226 C7H14O 2-Heptanone 0.714 0.407 0.297 C7H14O2 Heptanoic acid 3.840 2.282 1.488 1.041 C7H16 Heptane 0.757 0.523 0.387 0.301 0.243 C7H16 3-Methylhexane 0.350 C7H16O 1-Heptanol 5.810 2.603 1.389 0.849 C7H16O 2-Heptanol 3.955 1.799 0.987 0.615 C7H16O 3-Heptanol 1.957 0.976 0.584 C7H16O 4-Heptanol 4.207 1.695 0.882 0.539 C7H17N Heptylamine 1.314 0.865 0.600 0.434 C8H8 Styrene 1.050 0.695 0.507 0.390 0.310 C8H8O Acetophenone 1.681 0.634 C8H8O2 Methyl benzoate 1.857 C8H8O3 Methyl salicylate 1.102 0.815 C8H10 Ethylbenzene 0.872 0.631 0.482 0.380 0.304 C8H10 o-Xylene 1.084 0.760 0.561 0.432 0.345 C8H10 m-Xylene 0.795 0.581 0.445 0.353 0.289 C8H10 p-Xylene 0.603 0.457 0.359 0.290 C8H10O Phenetole 1.197 0.817 0.594 0.453 C8H11N N,N-Dimethylaniline 1.996 1.300 0.911 0.675 0.523 C8H11N N-Ethylaniline 3.981 2.047 1.231 0.825 0.596 C8H16 Ethylcyclohexane 1.139 0.784 0.579 C8H16O2 Octanoic acid 5.020 2.656 1.654 1.147 C8H18 Octane 0.700 0.508 0.385 0.302 0.243 C8H18O 1-Octanol 7.288 3.232 1.681 0.991 C8H18O 4-Methyl-3-heptanol 1.904 1.085 0.702 0.497 0.375 C8H18O 5-Methyl-3-heptanol 2.052 1.178 0.762 0.536 0.401 C8H18O 2-Ethyl-1-hexanol 20.7 6.271 2.631 1.360 0.810 C8H18O Dibutyl ether 1.417 0.918 0.637 0.466 0.356 0.281 C8H19N Dibutylamine 1.509 0.918 0.619 0.449 0.345 C8H19N Diisobutylamine 1.115 0.723 0.511 0.384 0.303 C9H7N Quinoline 3.337 1.892 1.201 0.833 C9H10 Indane 2.230 1.357 0.931 0.692 0.545 C9H12 Cumene 1.075 0.737 0.547

Molecular formula Name

–25 °C 0 °C 25 °C 50 °C 75 °C 100 °C

C9H14O Isophorone 4.201 2.329 1.415 0.923 0.638 C9H18O 5-Nonanone 1.199 0.834 0.619 0.484 C9H18O2 Nonanoic acid 7.011 3.712 2.234 1.475 C9H20 Nonane 0.964 0.665 0.488 0.375 0.300 C9H20O 1-Nonanol 9.123 4.032 C10H10O4 Dimethyl phthalate 63.2 14.4 5.309 2.824 1.980 C10H14 Butylbenzene 0.950 0.683 0.515 C10H18 cis-Decahydronaphthalene 12.8 5.645 3.042 1.875 1.271 0.924 C10H18 trans-Decahydronaphthalene 6.192 3.243 1.948 1.289 0.917 0.689 C10H20O2 Decanoic acid 4.327 2.651 C10H22 Decane 2.188 1.277 0.838 0.598 0.453 0.359 C10H22O 1-Decanol 10.9 4.590 C11H24 Undecane 1.707 1.098 0.763 0.562 0.433 C12H10O Diphenyl ether 2.130 1.407 1.023 C12H26 Dodecane 2.277 1.383 0.930 0.673 0.514 C13H12 Diphenylmethane 1.265 0.929 C13H28 Tridecane 2.909 1.724 1.129 0.796 0.594 C14H30 Tetradecane 2.128 1.376 0.953 0.697 C16H22O4 Dibutyl phthalate 483 66.4 16.6 6.470 3.495 2.425 C16H34 Hexadecane 3.032 1.879 1.260 0.899 C18H38 Octadecane 2.487 1.609 1.132