| CAS Number | 1375472-38-0 |
| Catalog Number | AG009ZTH |
| Chemical Name | 1-(3-Fluoro-4-methoxyphenyl)ethan-1-amine hydrochloride |
| IUPAC Name | 1-(3-fluoro-4-methoxyphenyl)ethanamine;hydrochloride |
| InChI | InChI=1S/C9H12FNO.ClH/c1-6(11)7-3-4-9(12-2)8(10)5-7;/h3-6H,11H2,1-2H3;1H |
| InChI Key | IWQJXEXCMWBMQV-UHFFFAOYSA-N |
| MDL Number | MFCD21602712 |
| Molecular Formula | C9H13ClFNO |
| Molecular Weight | 205.6570 |
| SMILES | Cl.FC=1C=C(C=CC1OC)C(C)N |
| Synonyms | 1-(3-fluoro-4-methoxyphenyl)ethan-1-amine hydrochloride,
1375472-38-0,
(S)-1-(3-Fluoro-4-methoxyphenyl)ethanamine hydrochloride,
1980007-86-0,
AKOS032947657,
NE38228,
4CH-019573,
AK00786227,
(1R)-1-(3-fluoro-4-methoxyphenyl)ethanamine;hydrochloride,
(R)-1-(3-Fluoro-4-methoxyphenyl)ethanamine hydrochloride,
1257106-70-9,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.657g/mol |
| Monoisotopic Mass | 205.067g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number