2IH
Summary
| Name: | 1,1'-HEXANE-1,6-DIYLBIS(1H-IMIDAZOLE) |
| Synonyms: | 1,6-DI(IMIDAZOL-1-YL)HEXANE |
| Formula: | C12 H18 N4 |
| Formal charge: | 0 |
| Formula weight: | 218.298 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1,1'-hexane-1,6-diylbis(1H-imidazole) |
| OpenEye OEToolkits | 1.5.0 | 1-(6-imidazol-1-ylhexyl)imidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1ccn(c1)CCCCCCn2ccnc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | C(CCCn1ccnc1)CCn2ccnc2 |
| SMILES | CACTVS | 3.341 | C(CCCn1ccnc1)CCn2ccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cn(cn1)CCCCCCn2ccnc2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cn(cn1)CCCCCCn2ccnc2 |
| InChI | InChI | 1.03 | InChI=1S/C12H18N4/c1(3-7-15-9-5-13-11-15)2-4-8-16-10-6-14-12-16/h5-6,9-12H,1-4,7-8H2 |
| InChIKey | InChI | 1.03 | CHRPUSCNMSNSKL-UHFFFAOYSA-N |
