| CAS Number | 1261861-04-4 |
| Catalog Number | AG01A6VF |
| Chemical Name | 1-(2-Amino-4-fluorophenyl)ethan-1-one hydrochloride |
| IUPAC Name | 1-(2-amino-4-fluorophenyl)ethanone;hydrochloride |
| InChI | InChI=1S/C8H8FNO.ClH/c1-5(11)7-3-2-6(9)4-8(7)10;/h2-4H,10H2,1H3;1H |
| InChI Key | UPJJVMHTNDUTCH-UHFFFAOYSA-N |
| MDL Number | MFCD18389568 |
| Molecular Formula | C8H9ClFNO |
| Molecular Weight | 189.6146 |
| SMILES | Cl.CC(C1=C(N)C=C(F)C=C1)=O |
| Synonyms | 1261861-04-4,
1-(2-amino-4-fluorophenyl)ethan-1-one hydrochloride,
1-(2-Amino-4-fluorophenyl)ethanone hydrochloride,
SCHEMBL4049299,
NE16311,
2'-Amino-4'-fluoroacetophenone hydrochloride,
456-00-8,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.036g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.614g/mol |
| Monoisotopic Mass | 189.036g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number