SAF
Summary
| Name: | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL |
| Formula: | C10 H15 N O |
| Formal charge: | 0 |
| Formula weight: | 165.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-[(1S)-1-(dimethylamino)ethyl]phenol |
| OpenEye OEToolkits | 1.5.0 | 3-[(1S)-1-dimethylaminoethyl]phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Oc1cc(ccc1)C(N(C)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](N(C)C)c1cccc(O)c1 |
| SMILES | CACTVS | 3.341 | C[CH](N(C)C)c1cccc(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](c1cccc(c1)O)N(C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(c1cccc(c1)O)N(C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H15NO/c1-8(11(2)3)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | GQZXRLWUYONVCP-QMMMGPOBSA-N |
