| ID | Name | CAS | Properties |
McVol (ml/mol) |
| 11-651-6 |
cis-5,8,11-Eicosatrienoic acid, 4,4-dimethyloxazoline (dmox) derivative
|
|
8 | 336.810 |
| 11-832-5 |
(R)-1-Methyl-4-(6-methylhept-5-en-2-yl)cyclohexa-1,4-diene
|
28976-67-2 |
8 | 198.450 |
| 12-284-3 |
2,6-difluorobenzoic acid, but-3-yn-2-yl ester
|
|
8 | 144.470 |
| 12-337-4 |
N''-(3-fluoro-phenyl)-N,N,N',N'-tetramethyl -guanidine
|
|
8 | 169.500 |
| 12-357-2 |
Avenaciolide, 1-dihydro-6-[2-(4-methylphenyl)ethyl]-4-demethylene
|
|
8 | 202.470 |
| 12-529-1 |
2,4,4,6,6,8,8-Heptamethyl-1-nonene
|
15796-04-0 |
8 | 232.000 |
| 12-658-8 |
myo-Inositol 3,4,5,6-tetraacetate, bis(trifluoroacetate) (isomer 1)
|
|
8 | 308.880 |
| 13-167-2 |
1,4,5,8-Dimethanonaphthalene, 1,4,4a,5,8,8a-hexahydro-, (1«alpha»,4«alpha»,4a«beta»,5«alpha»,8«alpha»,8a«beta»)-
|
83602-18-0 |
8 | 127.900 |
| 13-261-7 |
Phosphorothioic acid, O-(3-chloro-4-nitrophenyl) O,O-dimethyl ester
|
500-28-7 |
8 | 183.900 |
| 13-450-7 |
Succinic acid, 2-pentyl 1,1,1-trifluoro-2-propyl ester
|
|
8 | 200.130 |
| 13-582-1 |
myo-Inositol 3,4,5,6-tetraacetate, bis(trifluoroacetate) (isomer 2)
|
|
8 | 308.880 |
| 14-051-9 |
D-Alanine, N-(2,6-difluoro-3-methylbenzoyl)-, hexadecyl ester
|
|
8 | 390.060 |
| 14-347-1 |
Benzoic acid, 2-{3-[2-(diethylamino)ethyl]-3-methyltriazeno}-, methyl ester
|
127909-49-3 |
8 | 241.510 |
| 14-544-2 |
Cyclohexanecarboxylic acid, 3,4-dihydroxy-cis-3, cis-4, methyl ester
|
|
8 | 131.900 |
| 14-914-1 |
Tricyclo[4.2.1.02,5]non-7-ene-3,4-dione, (1«alpha»,2«beta»,5«beta»,6«alpha»)-
|
67792-55-6 |
8 | 103.930 |
| 15-181-4 |
1,1,1,4,5,5,5-heptafluoro-3-(pentafluoroethyl)-2,4-bis(trifluoromethyl)pent-2-ene
|
|
8 | 165.230 |
| 15-368-7 |
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1S-endo)-
|
5655-61-8 |
8 | 165.660 |
| 15-742-1 |
Diethylmalonic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester
|
|
8 | 265.340 |
| 15-956-4 |
2-[2-[2-[2-[2-[2-(2,2,3,3,3-Pentafluoropropanoyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,3,3,3-pentafluoropropanoate
|
|
8 | 326.410 |
| 16-226-3 |
Bicyclo[2.2.2]octane-1-carboxylic acid, 4-methyl-
|
702-67-0 |
8 | 137.480 |
| 16-738-5 |
Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, propyl ester
|
|
8 | 256.240 |
| 17-282-0 |
Benzoic acid, 4-amino-2-chloro-, 2-(diethylamino)ethyl ester
|
133-16-4 |
8 | 209.910 |
| 17-762-7 |
Benzoic acid, 4-hydroxy-2-methoxy-3,6-dimethyl-, methyl ester
|
34874-75-4 |
8 | 161.270 |
| 18-210-8 |
Acetic acid, [3-hydroxy-4,4'-carbonylbis(phenyleneoxy)di-], didodecyl ester
|
116436-40-9 |
8 | 575.090 |
| 18-502-4 |
2-Amino-3-(3-chloro-4-methyloxy-phenyl)propanoic acid, methyl ester
|
|
8 | 177.620 |
| 18-903-9 |
Phosphorodithioic acid, S-[2-(ethylthio)ethyl] O,O-dimethyl ester
|
640-15-3 |
8 | 176.650 |
| 18-938-1 |
Carbamic acid, (1-methylethyl)-, 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl ester
|
78-44-4 |
8 | 214.780 |
| 19-231-4 |
2,2,2-Trifluoro-N-[4-[4-[(2,2,2-trifluoroacetyl)amino]phenoxy]phenyl]acetamide
|
5252-79-9 |
8 | 228.370 |
| 19-244-0 |
L-2-Phenylglycine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester
|
|
8 | 237.400 |
| 19-280-0 |
Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexadecyl ester
|
|
8 | 414.890 |
| 19-435-8 |
2«alpha»,4«alpha»-Dimethyl-6«beta»-vinyl-1,3-dioxane
|
42411-78-9 |
8 | 120.160 |
| 19-944-3 |
N-(2,2,2-TRICHLORO-1,1-BIS(P-CHLOROPHENYL)ETHYL)ACETAMIDE
|
|
8 | 261.530 |
| 19-967-8 |
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, trans-
|
29803-81-4 |
8 | 142.470 |
| 19-999-3 |
(2E)-1,3-bis(4-ethoxyphenyl)-2-buten-1-one
|
|
8 | 254.150 |
| 20-022-4 |
[1R-(1«alpha»,2«alpha»,3«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol
|
19889-94-2 |
8 | 135.910 |
| 20-505-8 |
1-Propanone, 2-chloro-1-(2,5-dimethylphenyl)-2-methyl-
|
54965-52-5 |
8 | 169.990 |
| 20-507-6 |
Propane-1,3-diyl bis(2,3,4,5,6-pentafluorobenzoate)
|
|
8 | 235.450 |
| 20-862-2 |
D-Alanine, N-(2,6-difluoro-3-methylbenzoyl)-, hexyl ester
|
|
8 | 249.160 |
| 21-006-1 |
1,2-dibromo-3,7,8-trichloro-dibenzo-p-dioxin
|
|
8 | 205.020 |
| 21-112-3 |
Pregna-5,16-dien-20-one, 3-hydroxy-, (3«beta»)-
|
1162-53-4 |
8 | 262.150 |
| 21-478-8 |
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl, acetate
|
|
8 | 165.660 |
| 21-585-9 |
Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptyl ester
|
|
8 | 288.080 |
| 21-944-0 |
Tricyclo[4.2.0.0<sup>2,5</sup>]oct-3-ene,(1α,2β,5β,6α)-
|
39781-76-5 |
8 | 86.700 |
| 22-004-2 |
2,2,2-Trifluoro-N-[[4-[[(2,2,2-trifluoroacetyl)amino]methyl]phenyl]methyl]acetamide
|
|
8 | 189.900 |
| 22-334-6 |
(1R,4S)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl (E)-2-methylbut-2-enoate
|
|
8 | 203.630 |
| 22-612-7 |
Tricycloprop[cd,f,hi]indene,decahydro-,(1aα,1bα,1cβ,2aβ,2bα,2cα,2dα,2eα)-
|
|
8 | 97.460 |
| 22-627-1 |
D-Alanine, N-(2,6-difluoro-3-methylbenzoyl)-, heptadecyl ester
|
|
8 | 404.150 |
| 23-345-3 |
1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (cis)
|
20480-66-4 |
8 | 162.640 |
| 23-707-1 |
7-Oxabicyclo[4.1.0]heptane, 1-methyl-4-(1-methylethenyl)-
|
1195-92-2 |
8 | 131.610 |
| 23-772-9 |
Fumaric acid, monoamide, N-methyl-N-phenyl-, 2,4,6-trichlorophenyl ester
|
|
8 | 254.280 |
| 25-061-6 |
Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptadecyl ester
|
|
8 | 428.980 |
| 25-409-0 |
7-Oxabicyclo[2.2.1]heptane, 1-methyl-4-(1-methylethyl)-
|
|
8 | 135.910 |
| 26-335-1 |
Tricyclo[4.2.1.02,5]nonane-3,4-dione, syn-
|
|
8 | 108.230 |
| 26-551-1 |
Dimethylmalonic acid, butyl 2,2,3,4,4,4-hexafluorobutyl ester
|
|
8 | 219.530 |
| 26-655-6 |
Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octyl ester
|
|
8 | 302.170 |
| 26-671-8 |
(1«alpha»,3«alpha»,5«alpha»,7«alpha»)-3,8,8-trimethyl-4-oxatricyclo[5.1.0.03,5]octane
|
35671-18-2 |
8 | 153.230 |
| 26-851-8 |
D-Alanine, N-(2,6-difluoro-3-methylbenzoyl)-, undecyl ester
|
|
8 | 319.610 |
| 27-111-8 |
1,4-Anhydro-2,3,5-tri-O-methyl-D-ribitol
|
|
8 | 136.200 |
| 27-239-7 |
Fumaric acid, monoamide, N-methyl-N-phenyl-, 2-fluorophenyl ester
|
|
8 | 219.330 |
| 27-326-0 |
1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«beta»,5«beta»,8«beta»,8a«beta»,9«alpha»,9a«beta»,10«alpha»,10a«beta»)-
|
87480-43-1 |
8 | 180.930 |
| 27-449-4 |
TRICYCLO[5.2.1.0(2,6)]DECAN-8-ONE
|
|
8 | 120.750 |
| 27-454-8 |
Sebacic acid, di(2,6-dimethylnon-1-en-3-yn-5-yl) ester
|
|
8 | 450.820 |
| 27-638-4 |
1,3-Dioxane, 4-ethenyl-2,6-dimethyl-, (2«alpha»,4«beta»,6«alpha»)-
|
42411-77-8 |
8 | 120.160 |
| 27-681-6 |
endo-(2s,7R)-Tricyclo[6.2.2.0(2,7)]-4,9-dodecadiene-3,6-dione
|
2816-25-3 |
8 | 141.900 |
| 28-617-6 |
1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-galactitol
|
102850-59-9 |
8 | 170.250 |
| 29-655-3 |
N-(Trifluoroacetyl)-N-(4-(4-[(trifluoroacetyl)amino]phenoxy)phenyl)-2,2,2-trifluoroacetamide
|
|
8 | 263.430 |
| 29-784-0 |
Bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl-, [1R-(1«alpha»,2«beta»,3«alpha»,5«alpha»)]-
|
1196-00-5 |
8 | 135.910 |
| 29-913-6 |
1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-
|
87480-44-2 |
8 | 180.930 |
| 30-028-7 |
Fumaric acid, monoamide, N,N-dimethyl-, 3,4-dimethylphenyl ester
|
|
8 | 199.050 |
| 30-166-4 |
1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-mannitol
|
6001-00-9 |
8 | 170.250 |
| 30-199-8 |
1,5-Anhydro-2,3,4,6-tetra-O-methyl-D-glucitol
|
81874-02-4 |
8 | 170.250 |
| 30-244-7 |
1-Naphthoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester
|
|
8 | 258.070 |
| 30-645-2 |
Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isobutyl ester
|
|
8 | 249.640 |
| 30-894-6 |
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, cis-
|
|
8 | 142.470 |
| 31-081-7 |
1,4,4a,8a-Tetrahydro-1,4-methanonaphthalene-5,8-dione
|
1200-89-1 |
8 | 127.810 |
| 31-131-1 |
Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl decyl ester
|
|
8 | 330.350 |
| 31-533-5 |
2-[2-[2-[2-[2-(2,2,3,3,3-Pentafluoropropanoyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,3,3,3-pentafluoropropanoate
|
|
8 | 292.360 |
| 31-783-8 |
Adipic acid, 3,4-bis(3',4'-dimethoxyphenyl)-, dimethyl ester
|
|
8 | 339.860 |
| 31-840-4 |
Androst-5-ene-3,17-diol, 3-acetate, (3«beta»,17«beta»)-
|
1639-43-6 |
8 | 272.320 |
| 32-263-4 |
Bicyclo[2.2.1]hept-2-en-7-ol, anti-
|
694-70-2 |
8 | 89.340 |
| 32-395-8 |
M-xylene, alpha,alpha,alpha,alpha',alpha',alpha',5-heptafluoro-
|
35564-19-3 |
8 | 112.210 |
| 32-625-2 |
1,3,5(10)-Oestratrien-17«alpha»-ol, 3-methoxy
|
|
8 | 233.970 |
| 32-654-0 |
endo-Bicyclo[2.2.1]hept-5-en-2-carboxylic acid, 2-methyl, methyl ester
|
|
8 | 133.180 |
| 33-013-0 |
3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
|
|
8 | 237.540 |
| 33-550-4 |
Propanamide, N-(4-bromophenyl)-2,2,3,3,3-pentafluoro-
|
|
8 | 151.810 |
| 33-692-7 |
Tetracyclo[6.1.0.02,4.05,7]nonane(1α,2α,4α,5β,7β,8α)-
|
|
8 | 94.230 |
| 33-806-0 |
2,4-Dimethyl-1H-pyrrole-5-carboxylic acid methyl ester
|
|
8 | 121.540 |
| 33-876-3 |
Bicyclo[4.1.0]heptan-3-one, 4,7,7-trimethyl-, [1R-(1«alpha»,4«alpha»,6«alpha»)]-
|
4176-04-9 |
8 | 131.610 |
| 33-880-8 |
3-Cyclohexen-1-ol, 4-methyl-1-(1-methylethyl)-, (R)-
|
20126-76-5 |
8 | 142.470 |
| 34-383-9 |
1H-Indene, 2,3-dihydro-1,1,3-trimethyl-3-phenyl-
|
3910-35-8 |
8 | 206.100 |
| 34-722-2 |
2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-
|
13341-72-5 |
8 | 133.180 |
| 35-252-3 |
4,7-Ethanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-, (3a«alpha»,4«alpha»,7«alpha»,7a«alpha»)-
|
24327-08-0 |
8 | 123.890 |
| 35-805-9 |
Cyclohexanol, 2,5-di-tert-butyl-, cis-1,2, trans-1,5
|
14736-73-3 |
8 | 203.130 |
| 36-451-1 |
1,3,5-Triazine-2,4-diamine, N,N'-diethyl-6-methoxy-
|
673-04-1 |
8 | 155.590 |
| 37-084-8 |
2-[2-[2-[2-[2-[2-[2-[2-[2-(2,2,3,3,3-Pentafluoropropanoyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,3,3,3-pentafluoropropanoate
|
|
8 | 428.560 |
| 37-152-2 |
2,2,3,3,4,4,4-Heptafluoro-N-[4-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)phenoxy]phenyl]butanamide
|
|
8 | 298.890 |
| 38-017-1 |
(1«alpha»,3«beta»,5«beta»,7«alpha»)-3,8,8-trimethyl-4-oxatricyclo[5.1.0.03,5]octane
|
21218-11-1 |
8 | 153.230 |
| 38-427-6 |
Cyclohexane, 1,4-dimethyl-2-(2-methylpropyl)-, (1«alpha»,2«beta»,4«alpha»)-
|
54411-17-5 |
8 | 169.080 |
| 39-018-9 |
1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-
|
|
8 | 99.920 |
| 39-275-4 |
Benzene, 1,1',1'',1'''-(1-propyn-1-yl-3-ylidyne)tetrakis-
|
|
8 | 287.650 |
|
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