Anodyne| Threohydrobupropion | |
|---|---|
| Molecular structure via molpic based on CDK |
| Rotamer [] | |
|---|---|
| Conformer structure via 3Dmol.js |
| Physical properties [] | |
|---|---|
| Molecular mass | 241.76 g/mol [1] |
| Predicted LogP | 2.7 [1] |
| Structural Identifiers [] | |
|---|---|
| Molecular formula | C13H20ClNO [1] |
| IUPAC name | (1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-ol [1] |
| SMILES | C[C@@H]([C@H](C1=CC(=CC=C1)Cl)O)NC(C)(C)C [1] |
| InChI | InChI=1S/C13H20ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,12,15-16H,1-4H3/t9-,12+/m0/s1 [1] |
| InChIKey | NDPTTXIBLSWNSF-JOYOIKCWSA-N [1] |
Threohydrobupropion
Threohydrobupropion (also known as Benzenemethanol, 3-chloro-α-((1R)-1-((1,1-dimethylethyl)amino)ethyl)-, (αR)-rel-, RefChem:879173, rel-(αR)-3-Chloro-α-((1R)-1-((1,1-dimethylethyl)amino)ethyl)benzenemethanol, rac threo-Dihydrobupropion, rac threo-Dihydro Bupropion, (1S,2S)-2-(tert-Butylamino)-1-(3-chlorophenyl)propan-1-ol, Threo-dihydrobupropion, 153365-82-3, (R*,R*)-3-Chloro-α-[1-[(1,1-dimethylethyl)amino]ethyl]benzenemethanol or Bupropion Impurity 71) is a
Chemistry
Stereochemistry []
Threohydrobupropion is a achiral mixture of the optical stereoisomers
See also []
External links []
References []
National Center for Biotechnology Information. PubChem Compound Summary for CID 9834682, Threohydrobupropion. Accessed August 31, 2025. https://pubchem.ncbi.nlm.nih.gov/compound/9834682
U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. Threohydrobupropion. UNII: 988C8SFV4F. Global Substance Registration System. Accessed August 31, 2025. https://gsrs.ncats.nih.gov/ginas/app/beta/substances/988C8SFV4F