Datasets:
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name
stringclasses 8
values | SMILES
stringclasses 8
values | Molar
int64 1
4
| rate
float64 0.01
0.06
| n_carbons
int64 1
11
|
|---|---|---|---|---|
Methyl acrylate | C=CC(OC)=O | 1 | 0.013 | 1 |
Methyl acrylate | C=CC(OC)=O | 2 | 0.013 | 1 |
Methyl acrylate | C=CC(OC)=O | 4 | 0.023 | 1 |
ethyl acrylate | CCOC(=O)C=C | 1 | 0.021 | 2 |
ethyl acrylate | CCOC(=O)C=C | 2 | 0.026 | 2 |
ethyl acrylate | CCOC(=O)C=C | 4 | 0.034 | 2 |
propyl acrylate | CCCOC(=O)C=C | 1 | 0.018 | 3 |
propyl acrylate | CCCOC(=O)C=C | 2 | 0.027 | 3 |
propyl acrylate | CCCOC(=O)C=C | 4 | 0.05 | 3 |
n-butyl acrylate | CCCCOC(=O)C=C | 1 | 0.024 | 4 |
n-butyl acrylate | CCCCOC(=O)C=C | 2 | 0.038 | 4 |
n-butyl acrylate | CCCCOC(=O)C=C | 4 | 0.044 | 4 |
iso-butyl acrylate | CC(C)COC(=O)C=C | 1 | 0.021 | 4 |
iso-butyl acrylate | CC(C)COC(=O)C=C | 2 | 0.03 | 4 |
iso-butyl acrylate | CC(C)COC(=O)C=C | 4 | 0.039 | 4 |
2-ethyl-hexyl acrylate | CCCCC(CC)COC(=O)C=C | 1 | 0.026 | 6 |
2-ethyl-hexyl acrylate | CCCCC(CC)COC(=O)C=C | 2 | 0.039 | 6 |
2-ethyl-hexyl acrylate | CCCCC(CC)COC(=O)C=C | 4 | 0.05 | 6 |
cyclohexyl acrylate | C=CC(=O)OC1CCCCC1 | 1 | 0.031 | 6 |
cyclohexyl acrylate | C=CC(=O)OC1CCCCC1 | 2 | 0.048 | 6 |
cyclohexyl acrylate | C=CC(=O)OC1CCCCC1 | 4 | 0.061 | 6 |
dodecyl acryalte | CCCCCCCCCCCCOC(=O)C=C | 1 | 0.035 | 11 |
dodecyl acryalte | CCCCCCCCCCCCOC(=O)C=C | 2 | 0.049 | 11 |
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