V9P
Summary
| Name: | 1-(2-chloroethyl)-1H-imidazole |
| Formula: | C5 H7 Cl N2 |
| Formal charge: | 0 |
| Formula weight: | 130.575 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(2-chloroethyl)-1H-imidazole |
| OpenEye OEToolkits | 2.0.7 | 1-(2-chloroethyl)imidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | ClCCn1ccnc1 |
| InChI | InChI | 1.06 | InChI=1S/C5H7ClN2/c6-1-3-8-4-2-7-5-8/h2,4-5H,1,3H2 |
| InChIKey | InChI | 1.06 | WQRYDDUXWFSPQG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ClCCn1ccnc1 |
| SMILES | CACTVS | 3.385 | ClCCn1ccnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cn(cn1)CCCl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cn(cn1)CCCl |
