02R
Summary
| Name: | 1-(2-chlorophenyl)methanamine |
| Formula: | C7 H8 Cl N |
| Formal charge: | 0 |
| Formula weight: | 141.598 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(2-chlorophenyl)methanamine |
| OpenEye OEToolkits | 1.7.2 | (2-chlorophenyl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccccc1CN |
| InChI | InChI | 1.03 | InChI=1S/C7H8ClN/c8-7-4-2-1-3-6(7)5-9/h1-4H,5,9H2 |
| InChIKey | InChI | 1.03 | KDDNKZCVYQDGKE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | NCc1ccccc1Cl |
| SMILES | CACTVS | 3.370 | NCc1ccccc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1ccc(c(c1)CN)Cl |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(c(c1)CN)Cl |
