TPA
Summary
| Name: | TRANS-2-PHENYLCYCLOPROPYLAMINE |
| Formula: | C9 H12 N |
| Formal charge: | 1 |
| Formula weight: | 134.198 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (1S,2R)-2-phenylcyclopropanaminium |
| OpenEye OEToolkits | 1.5.0 | [(1S,2R)-2-phenylcyclopropyl]azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | c1cccc(c1)C2CC2[NH3+] |
| SMILES_CANONICAL | CACTVS | 3.341 | [NH3+][C@H]1C[C@@H]1c2ccccc2 |
| SMILES | CACTVS | 3.341 | [NH3+][CH]1C[CH]1c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)[C@H]2C[C@@H]2[NH3+] |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2CC2[NH3+] |
| InChI | InChI | 1.03 | InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/p+1/t8-,9+/m1/s1 |
| InChIKey | InChI | 1.03 | AELCINSCMGFISI-BDAKNGLRSA-O |
