| CAS Number | 1261838-05-4 |
| Catalog Number | AG01B7W6 |
| Chemical Name | 1-(5-amino-2-fluorophenyl)ethanone hcl |
| IUPAC Name | 1-(5-amino-2-fluorophenyl)ethanone;hydrochloride |
| InChI | InChI=1S/C8H8FNO.ClH/c1-5(11)7-4-6(10)2-3-8(7)9;/h2-4H,10H2,1H3;1H |
| InChI Key | CDDLMWGEHLGCLL-UHFFFAOYSA-N |
| MDL Number | MFCD18389576 |
| Molecular Formula | C8H9ClFNO |
| Molecular Weight | 189.6146 |
| SMILES | Cl.CC(C1=C(F)C=CC(N)=C1)=O |
| Synonyms | 1-(5-AMINO-2-FLUOROPHENYL)ETHANONE HCL,
1261838-05-4,
1-(5-amino-2-fluorophenyl)ethan-1-one hydrochloride,
1-(5-Amino-2-fluorophenyl)ethanone hydrochloride,
MFCD18389576,
AKOS027254455,
AS-36219,
Z2037273341,
67500-19-0,
|
| 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 |
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Certificate of Analysis
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