| CAS Number | 1255705-12-4 |
| Catalog Number | AG00J1HS |
| Chemical Name | rac-[(1R,2R)-2-(4-fluorobenzyl)cyclopentyl]amine hydrochloride |
| IUPAC Name | 2-[(4-fluorophenyl)methyl]cyclopentan-1-amine;hydrochloride |
| InChI | InChI=1S/C12H16FN.ClH/c13-11-6-4-9(5-7-11)8-10-2-1-3-12(10)14;/h4-7,10,12H,1-3,8,14H2;1H |
| InChI Key | LBAXGHUZSNHAJY-UHFFFAOYSA-N |
| MDL Number | MFCD28038734 |
| Molecular Formula | C12H17ClFN |
| Molecular Weight | 229.7215 |
| SMILES | [C@@H]1(CCC[C@H]1N)CC1C=CC(F)=CC=1.Cl |
| Synonyms | (1R,2R)-2-(4-Fluorobenzyl)cyclopentanamine hydrochloride,
1255705-12-4,
MCULE-8569111830,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.723g/mol |
| Monoisotopic Mass | 229.103g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number