| Chemical name | 2,4-hexadienal | |
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| Chemical name | t,t-2,4-hexadienal | |
| CAS RN | 142-83-6 | |
| SMILES | O=CC=CC=CC | |
| FORMULA | C6H8O | |
| Molecular weight | 96.058 | |
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| 1 | Q17-10-1-241 | Nonlinear QSAR: artificial neural network for classification of skin sensitisation potential | 1 | Training set (data_training) |
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| 2 | Q17-22-1-332 | Nonlinear QSAR: artificial neural network for dermal irritation | 1 | Dermal_Irritation_PII_training_ 146.sdf (data_training) |
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| # | File | File format | Description | Type | Updated | |
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| 1 | Skin_Sensitation_training_215.sdf | sdf | Training set | data_training | 2010-07-18 13:21:28.0 |
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| 2 | Skin_Sensitation_test_23.sdf | sdf | test set | data_validation | 2010-07-18 13:21:43.0 |
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