| CAS Number | 1216236-80-4 |
| Catalog Number | AG01BVG8 |
| Chemical Name | 2-(3-fluoro-4-methoxyphenyl)propan-2-amine |
| IUPAC Name | 2-(3-fluoro-4-methoxyphenyl)propan-2-amine |
| InChI | InChI=1S/C10H14FNO/c1-10(2,12)7-4-5-9(13-3)8(11)6-7/h4-6H,12H2,1-3H3 |
| InChI Key | SBOGMHMDLJRRPR-UHFFFAOYSA-N |
| MDL Number | MFCD14529685 |
| Molecular Formula | C10H14FNO |
| Molecular Weight | 183.2227 |
| SMILES | COC1=C(F)C=C(C(N)(C)C)C=C1 |
| Synonyms | 2-(3-fluoro-4-methoxyphenyl)propan-2-amine,
1216236-80-4,
ZINC36156426,
AKOS012090991,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.226g/mol |
| Monoisotopic Mass | 183.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number