| ID | Name | CAS | Data |
McVol (ml/mol) |
| 125-154-2 |
Benzamide, 3-fluoro-4-trifluoromethyl-N-(3-fluoro-4-trifluoromethylbenzoyl)-N-(2-ethylhexyl)-
|
|
5 | 328.780 |
| 125-165-0 |
Benzamide, 3-fluoro-4-trifluoromethyl-N-(3-fluoro-4-trifluoromethylbenzoyl)-N-pentyl-
|
|
5 | 286.510 |
| 125-178-6 |
Fumaric acid, 1-phenylprop-1-yl 1,1,1-trifluoroprop-2-yl ester
|
|
5 | 228.430 |
| 125-179-5 |
Fumaric acid, 1-phenylprop-1-yl 2,2,3,3-tetrafluoropropyl ester
|
|
5 | 230.200 |
| 125-183-0 |
Fumaric acid, 1-phenylprop-1-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester
|
|
5 | 265.460 |
| 125-227-1 |
2,5-Difluorobenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester
|
|
5 | 266.410 |
| 125-248-8 |
Glutaric acid, 2,2,3,3-tetrafluoropropyl 2-methoxyphenyl ester
|
|
5 | 226.280 |
| 125-249-7 |
Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-methoxyphenyl ester
|
|
5 | 224.510 |
| 125-303-6 |
Glutaric acid, 2,2,3,3-tetrafluoropropyl 2,4-dimethylpent-3-yl ester
|
|
5 | 244.170 |
| 125-304-5 |
Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,4-dimethylpent-3-yl ester
|
|
5 | 279.430 |
| 128-367-3 |
N,N-dimethyl-3-[1-(phenylmethyl)cycloheptyl]oxypropan-1-amine
|
|
5 | 259.800 |
| 10-509-5 |
pyrrolidino[1,2-e]-4H-2,4-dimethyl-1,3,5-dithiazine
|
|
4 | 144.540 |
| 11-470-7 |
Bicyclo[2.2.1]hept-2-ene, 5-(bromomethyl)-1,2,3,4,7,7-hexachloro-
|
|
4 | 188.500 |
| 11-554-4 |
2,2,4,4,6-Pentachloro-5-cyclohexene-1,3-dione
|
15679-05-7 |
4 | 144.580 |
| 11-646-2 |
4-Methyl-n-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)benzenesulfonamide
|
|
4 | 209.340 |
| 11-999-1 |
2,7,12,17-Tetraethyl-3,8,13,18-tetramethyl-21H,23H-porphin
|
448-71-5 |
4 | 400.060 |
| 12-207-8 |
2,6-Pyridinedicarboxylic acid, isobutyl 3-(2-methoxyethyl)nonyl ester
|
|
4 | 341.900 |
| 12-292-4 |
(+)tr-4,5-Bis(iodomethyl)-2,2-dimethyl-1,3-dioxolane
|
|
4 | 162.010 |
| 12-585-9 |
O-methyl o,o-bis(2,4,5-trichlorophenyl) thiophosphate
|
56201-37-7 |
4 | 274.370 |
| 13-282-4 |
Phenol, 2,6-dimethoxy-4-(5,5-dimethyl-2-oxazolin-2-yl)-
|
116595-28-9 |
4 | 188.570 |
| 13-592-0 |
trans-2-[2'-(2"-Methyl-1"-propenyl)cyclopropyl]propan-2-ol
|
38996-80-4 |
4 | 142.470 |
| 13-737-9 |
Benzoic acid, 2-[[ethoxy[(1-methylethyl)amino]phosphinothioyl]oxy]-, 1-methylethyl ester
|
|
4 | 264.420 |
| 13-841-3 |
9H-purine, 2-amino-6-methyl-9-beta-d-ribofuranosyl-
|
|
4 | 189.450 |
| 13-844-0 |
1,5-diazabicyclo[4.4.0]dec-6-ene (DBD)
|
|
4 | 117.520 |
| 13-864-8 |
1H-Indene, 2,3-dihydro-1,1,2,3,3-pentamethyl-
|
|
4 | 173.500 |
| 14-060-9 |
1,4-Dihydro-1,2,3,4,9,9-hexachloro-1,4-methanonaphthalene-5,8-diol
|
5210-87-7 |
4 | 201.250 |
| 14-075-3 |
9H-purine-6(1h)-thione, 1-methyl-9-beta-d-ribofuranosyl-
|
|
4 | 195.820 |
| 14-195-0 |
1,2,4-Methenocyclopenta[cd]pentalene-5-carboxaldehyde, 2,2a,3,3,4,7-hexachlorodecahydro-, (1«alpha»,2«beta»,2a«beta»,4«beta»,4a«beta»,5«beta»,6a«beta»,6b«beta»,7R*)-
|
7421-93-4 |
4 | 200.650 |
| 14-615-3 |
Cyclohexanone, 2-(3-chloro-2-butenyl)-2-methyl-6,6-diphenyl-
|
|
4 | 286.060 |
| 15-327-2 |
Cyclohexanecarboxylic acid, 1,3-dihydroxy-4,5-(isopropylidenedioxy)-, gamma-lactone, 1-acetate
|
|
4 | 173.980 |
| 15-544-1 |
1,4,4-(CH3)3-1,2,3,4-tetrahydropyridine
|
|
4 | 118.400 |
| 15-634-1 |
Valeric acid, 3-hydroxy-2,2,4-trimethyl, beta-lactone
|
|
4 | 120.160 |
| 15-730-4 |
3-Thiophenamine, tetrahydro-N-methyl-N-nitroso-, 1,1-dioxide
|
|
4 | 120.070 |
| 15-907-8 |
Naphthalene, 3,4,4a,5,6,7,8,8a-octahydro-7-isopropylene-1,4a-dimethyl-
|
35387-23-6 |
4 | 191.890 |
| 15-953-7 |
Bicyclo[2.2.1]hept-2-ene, 1,2,3,4,5,7,7-heptachloro-
|
5202-36-8 |
4 | 169.150 |
| 16-119-2 |
Cyclohexanemalonic acid, 5-hydroxy-2-(1-hydroxyethyl)-4,4-dimethyl-alpha-[1-(dimethylamino)prop-2-yl]-gamma,delta-dilactone
|
|
4 | 256.760 |
| 16-851-9 |
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)-
|
28239-47-6 |
4 | 207.840 |
| 16-907-7 |
8-Azabicyclo[3.2.1]octane-3,6-diol, diacetate (ester)
|
20399-48-8 |
4 | 183.080 |
| 17-583-6 |
«alpha»-D-Glucopyranoside, 1,3,4,6-tetra-O-methyl-«beta»-D-fructofuranosyl 2,3,4-tri-O-methyl-6-O-(2,3,4,6-tetra-O-methyl-«alpha»-D-galactopyranosyl)-
|
34141-00-9 |
4 | 480.810 |
| 18-266-7 |
2,2,2-Trichloro-n,n'-bis(p-bromophenyl) ethylidene diamine
|
|
4 | 252.280 |
| 18-878-8 |
2,4-Dimethoxy-6-(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
|
|
4 | 169.890 |
| 19-082-0 |
1H-Pyrazole, 3,5-bis(1,1-dimethylethyl)-4-methyl-
|
18712-47-5 |
4 | 180.440 |
| 19-619-4 |
Thiosulfuric acid (H2S2O3), S-[2-[(tetrahydro-1,1-dioxido-3-thienyl)amino]ethyl] ester
|
37018-35-2 |
4 | 172.920 |
| 19-679-8 |
2,3-Diazabicyclo[2.2.2]octa-2,5-diene N-oxide
|
37436-17-2 |
4 | 90.910 |
| 20-256-5 |
1H-Indene, 1,1,2,3,4,5,6,7-octafluoro-
|
|
4 | 112.910 |
| 20-545-4 |
Methanone, bis(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)-
|
|
4 | 233.000 |
| 21-375-2 |
2-Naphthalenol, 1-[[2-methyl-4-[(2-methylphenyl)azo]phenyl]azo]-
|
85-83-6 |
4 | 295.470 |
| 22-119-5 |
3-Cyano-4-methoxymethyl-5-nitro-6-methyl-(2-pyridone)
|
|
4 | 154.430 |
| 22-220-2 |
7-Chloro-3-methyl-quinoline-8-carboxylic acid, ethyl ester
|
|
4 | 180.470 |
| 22-237-4 |
Cholesta-8,24-dien-3-ol, acetate, (3.beta.,5.alpha.)-
|
|
4 | 374.870 |
| 22-425-5 |
6S-2,3,8,8-Tetramethyltricyclo[5.2.2.0(1,6)]undec-2-ene
|
137235-48-4 |
4 | 185.330 |
| 22-640-6 |
2-Pentene-1-thione,4,4,5,5-tetrafluoro-3-hydroxy-1-phenyl-
|
|
4 | 162.790 |
| 22-683-9 |
2,6-Pyridinedicarboxylic acid, 2-methylhex-3-yl 2-octyl ester
|
|
4 | 321.940 |
| 22-864-8 |
4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (hydroxyl-N-acetyl)-isomer 1, acetylated
|
|
4 | 243.270 |
| 23-137-4 |
Menthyl 5-methyl-bicyclo[2.2.1]hept-2-en-5-carboxylate
|
|
4 | 249.130 |
| 23-353-4 |
6-Chloro-N,N'-(cyclopentyl)-[1,3,5]triazine-2,4-diamine
|
|
4 | 210.690 |
| 23-404-7 |
3aH-Cyclopentacycloocten-3a-ol, 1,2,3,4,7,8,9,9a-octahydro-1,5,8,8-tetramethyl-, [1R-(1«alpha»,3a«beta»,9a«alpha»)]-
|
58542-75-9 |
4 | 202.060 |
| 23-441-6 |
5-ethyl-7-pentyl-1,2,3,4,6-pentathiepane
|
|
4 | 208.560 |
| 23-495-7 |
Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«alpha»-D-mannopyranoside
|
|
4 | 283.660 |
| 23-881-8 |
L-Tyrosine, N,O-bis(2,6-difluorobenzoyl)-, methyl ester
|
|
4 | 311.250 |
| 24-187-8 |
cis-5,8,11,14,17-Eicosapentaenoic acid, picolinyl ester
|
|
4 | 349.360 |
| 24-259-8 |
D-Alanine, N-(2,4,5-trifluoro-3-methoxybenzoyl)-, propyl ester
|
|
4 | 214.530 |
| 24-360-5 |
7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-6-one, dodecahydro-, [7R-(7«alpha»,7a«alpha»,14«alpha»,14a«alpha»)]-
|
1218-51-5 |
4 | 200.300 |
| 24-406-4 |
1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline
|
10421-76-8 |
4 | 287.510 |
| 24-863-7 |
Phosphorothioic acid, O,O-diethyl O-[2-(ethylsulfinyl)ethyl] ester
|
|
4 | 200.220 |
| 25-279-5 |
4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,5-dihydro-
|
|
4 | 88.180 |
| 25-709-7 |
Pyrido[3,4-d]pyrimidine-2,4(1H,3H)-dione
|
|
4 | 107.950 |
| 25-777-2 |
N-tert-Butyl-6-chlor-[1,3,5]triazin-2,4-diamine
|
|
4 | 147.870 |
| 26-296-5 |
1H-Indole, 2,3-dihydro-1,3,3-trimethyl-2-methylene-
|
118-12-7 |
4 | 151.000 |
| 27-514-1 |
2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propenyl)-
|
551-45-1 |
4 | 125.650 |
| 28-313-3 |
17-«alpha»-Methyl-5-«beta»-androst-1-ene-3-«alpha»,17-«beta»-diol
|
|
4 | 256.660 |
| 28-714-8 |
4-Heptene-3-thione,6,6,7,7-tetrafluoro-5-hydroxy-
|
88566-62-5 |
4 | 130.190 |
| 28-741-8 |
Androsta-1,4-diene-16beta-propionic acid, 17beta-hydroxy-3-oxo-, delta-lactone
|
|
4 | 266.950 |
| 28-747-2 |
Sebacic acid, di(2,7-dimethylocta-7-en-5-yn-4-yl) ester
|
|
4 | 422.640 |
| 29-107-1 |
4-Isopropyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane
|
51486-55-6 |
4 | 125.840 |
| 29-118-9 |
3-[Bis(4-methoxyphenyl)amino]-2-benzofuran-1(3h)-one
|
95166-04-4 |
4 | 267.860 |
| 29-126-0 |
5,6-Dihydro-5-methyl-4H-1,3,5-dithiazine
|
|
4 | 99.040 |
| 29-665-2 |
2,6-Naphthalenedicarboxylic acid, 3-[4-[decahydro-5-hydroxy-1-(methoxycarbonyl)-1-methyl-2-naphthalenyl]butyl]-1-methoxy-7-methyl-, dimethyl ester
|
56704-52-0 |
4 | 444.950 |
| 30-686-7 |
Cyclopropanecarboxylic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester
|
|
4 | 191.800 |
| 31-743-2 |
2,6-Pyridinedicarboxylic acid, 2-chloro-6-fluorophenyl ethyl ester
|
|
4 | 213.560 |
| 31-790-0 |
1H-Pyrrole, 3-ethyl-5-[(4-ethyl-3,5-dimethyl-2H-pyrrol-2-ylidene)methyl]-2,4-dimethyl-
|
2407-83-2 |
4 | 227.130 |
| 31-938-6 |
Phosphorothioic acid, O-(1,6-dihydro-6-oxo-1-phenyl-3-pyridazinyl) O,O-diethyl ester
|
119-12-0 |
4 | 240.850 |
| 32-032-0 |
(+)-(1R,6R,10S)-Amorpha-4,7(11)-dien-2-one
|
|
4 | 193.460 |
| 32-281-4 |
6-Methyl-3,5-heptadien-2-one, PFBO # 1
|
|
4 | 210.250 |
| 32-347-1 |
4-(3-Methyl-2-oxobutoxy)-7H-furo[3,2-g][1]benzopyran-7-one
|
5058-15-1 |
4 | 202.970 |
| 32-352-5 |
1,4:3,6-dianhydro-5-deoxy-2-O-(2,2,3,3,4,4,4-heptafluorobutanoyl)-D-xylo-hex-5-enitol
|
|
4 | 157.310 |
| 32-504-6 |
7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-E][1,5]diazocin-6-one, dodecahydro-, [7R-(7«alpha»,7a«alpha»,14«alpha»,14a«beta»)]-
|
489-72-5 |
4 | 200.300 |
| 32-602-7 |
Isonipecotic acid, N-(2,6-difluoro-3-methylbenzoyl)-, ethyl ester
|
|
4 | 224.210 |
| 32-834-0 |
8-Azabicyclo[3.2.1]octane, 3-[(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)oxy]-8-methyl-, endo-
|
604-51-3 |
4 | 270.680 |
| 33-098-7 |
2H-1-Benzopyran-2-one, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-
|
495-02-3 |
4 | 244.360 |
| 33-233-6 |
3-Cyclopentylpropionic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester
|
|
4 | 204.770 |
| 33-284-0 |
4-Methyl-N-((4-methyl-1-piperazinyl)carbonyl)-benzenesulfonamide, N-methyl-
|
|
4 | 233.100 |
| 33-499-2 |
O-(2,4,5-trichlorophenyl) n,n,n',n'-tetramethyldiamidothiophosphate
|
|
4 | 227.360 |
| 33-627-9 |
6-Amino-1,3,5-triazine-2,4(1H,3H)-dione
|
645-93-2 |
4 | 81.030 |
| 33-830-3 |
Piperidine, 1,1'-([1,1'-biphenyl]-4,4'-diyldicarbonyl)bis-
|
|
4 | 302.880 |
| 33-902-3 |
1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester
|
5463-44-5 |
4 | 153.050 |
| 33-908-7 |
2,3-Diazabicyclo[2.2.1]heptane,2,3-dimethyl-,(2-endo,3-exo)-
|
|
4 | 107.730 |
| 34-052-6 |
2,6-Pyridinedicarboxylic acid, di(2-chloro-6-fluorophenyl) ester
|
|
4 | 260.170 |
| 34-503-5 |
2-Dimethylamino-1-phenothiazin-10-yl-propan-1-one (from Secergan)
|
|
4 | 229.890 |
| 34-809-6 |
6Alpha-(p-nitrobenzamido)-3alpha,5-cyclo-5alpha-androstan-17-one
|
103064-86-4 |
4 | 329.680 |
|
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