| CAS Number | 1306605-32-2 |
| Catalog Number | AG01AI30 |
| Chemical Name | [2-(3-fluorophenyl)ethyl](propyl)amine hydrochloride |
| IUPAC Name | N-[2-(3-fluorophenyl)ethyl]propan-1-amine;hydrochloride |
| InChI | InChI=1S/C11H16FN.ClH/c1-2-7-13-8-6-10-4-3-5-11(12)9-10;/h3-5,9,13H,2,6-8H2,1H3;1H |
| InChI Key | CITGVAFEVUSSQI-UHFFFAOYSA-N |
| MDL Number | MFCD18838804 |
| Molecular Formula | C11H17ClFN |
| Molecular Weight | 217.7108 |
| SMILES | Cl.CCCNCCC1=CC(F)=CC=C1 |
| Synonyms | [2-(3-fluorophenyl)ethyl](propyl)amine hydrochloride,
1306605-32-2,
MCULE-5074694259,
NE30997,
EN300-76581,
Z1267881689,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.712g/mol |
| Monoisotopic Mass | 217.103g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number