A1L3F
(5-chloranylpyridin-2-yl)methanamine
| Created: | 2024-08-02 |
| Last modified: | 2025-05-28 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 16 |
| Chiral Atom Count | 0 |
| Bond Count | 16 |
| Aromatic Bond Count | 6 |
Chemical Component Summary | |
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| Name | (5-chloranylpyridin-2-yl)methanamine |
| Systematic Name (OpenEye OEToolkits) | (5-chloranylpyridin-2-yl)methanamine |
| Formula | C6 H7 Cl N2 |
| Molecular Weight | 142.586 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 3.385 | NCc1ccc(Cl)cn1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1Cl)CN |
| Canonical SMILES | CACTVS | 3.385 | NCc1ccc(Cl)cn1 |
| Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1Cl)CN |
| InChI | InChI | 1.06 | InChI=1S/C6H7ClN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H,3,8H2 |
| InChIKey | InChI | 1.06 | KQJKUOYVWLBSDN-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 21069929 |
| ChEMBL | CHEMBL4583748 |
