HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178745708Generated: October 30, 2026
6-Chloro-N-(3-pyridinylmethyl)-4-pyrimidinamine
6-Chloro-N-(3-pyridinylmethyl)-4-pyrimidinamine · 6-chloro-N-(pyridin-3-ylmethyl)pyrimidin-4-amine · 4-Pyrimidinamine, 6-chloro-N-(3-pyridinylmethyl)-
https://huagongshe.com/en/chemical/178745708
Identifiers & Physical Properties
| CAS No. | 1219957-80-8 |
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| Molecular formula | C10H9ClN4 |
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| Average molar mass | 220.66 g/mol |
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| SMILES | Clc1cc(NCc2cccnc2)ncn1 |
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| InChIKey | DJWINMRNCRGELU-UHFFFAOYSA-N |
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Chemical & Physical Properties
| XLogP | 1.9 |
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| Topological polar surface area | 50.7 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 15 |
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| Formal charge | 0 |
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| Complexity | 190 |
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| Boiling point | 414.5±35.0 °C(Predicted) |
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| Density | 1.368±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | 4.84±0.10(Predicted) |
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| Hazard class | IRRITANT |
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