| CAS Number | 1375068-38-4 |
| Catalog Number | AG01A4V4 |
| Chemical Name | 2-(4-Fluoro-3-methylphenyl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(4-fluoro-3-methylphenyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C9H12FN.ClH/c1-7-6-8(4-5-11)2-3-9(7)10;/h2-3,6H,4-5,11H2,1H3;1H |
| InChI Key | NYNJPLSUFZPVKJ-UHFFFAOYSA-N |
| MDL Number | MFCD09704702 |
| Molecular Formula | C9H13ClFN |
| Molecular Weight | 189.6576 |
| SMILES | Cl.CC1=C(F)C=CC(CCN)=C1 |
| Synonyms | 2-(4-fluoro-3-methylphenyl)ethan-1-amine hydrochloride,
1375068-38-4,
4-Fluoro-3-methylphenethylamine Hydrochloride,
NE56292,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.658g/mol |
| Monoisotopic Mass | 189.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number