| CAS Number | 1807938-62-0 |
| Catalog Number | AG0022CD(AGN-PC-0WNGSA) |
| Chemical Name | (1S,2R)-Rel-2-(4-chloro-3-fluorophenyl)cyclopropan-1-amine hcl |
| IUPAC Name | (1S,2R)-2-(4-chloro-3-fluorophenyl)cyclopropan-1-amine;hydrochloride |
| InChI | InChI=1S/C9H9ClFN.ClH/c10-7-2-1-5(3-8(7)11)6-4-9(6)12;/h1-3,6,9H,4,12H2;1H/t6-,9+;/m1./s1 |
| InChI Key | HUBHZRKHOYLABE-VNUWRVCDSA-N |
| MDL Number | MFCD28145465 |
| Molecular Formula | C9H10Cl2FN |
| Molecular Weight | 222.0868 |
| SMILES | Cl.N[C@H]1C[C@@H]1C1=CC(F)=C(Cl)C=C1 |
| Synonyms | 1807938-62-0,
(1S,2R)-rel-2-(4-Chloro-3-fluorophenyl)cyclopropan-1-amine HCl,
(1S,2R)-rel-2-(4-chloro-3-fluorophenyl)cyclopropan-1-amine hydrochloride,
(1S,2R)-2-(4-Chloro-3-fluorophenyl)cyclopropanamine hydrochloride,
MFCD30502625,
AKOS030627752,
AS-53384,
CS-0053581,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.084g/mol |
| Monoisotopic Mass | 221.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number