| CAS Number | 869937-08-6 |
| Catalog Number | AG00IEAP(AGN-PC-0WAN9J) |
| Chemical Name | 1-(2-Amino-6-fluorophenyl)ethanone |
| IUPAC Name | 1-(2-amino-6-fluorophenyl)ethanone |
| InChI | InChI=1S/C8H8FNO/c1-5(11)8-6(9)3-2-4-7(8)10/h2-4H,10H2,1H3 |
| InChI Key | DBBGVWWGWKITGW-UHFFFAOYSA-N |
| MDL Number | MFCD12025288 |
| Molecular Formula | C8H8FNO |
| Molecular Weight | 153.1536 |
| SMILES | CC(C1=C(F)C=CC=C1N)=O |
| Synonyms | 1-(2-Amino-6-fluorophenyl)ethanone,
869937-08-6,
1-(2-amino-6-fluorophenyl)ethan-1-one,
SCHEMBL14454258,
KS-00000S2M,
MFCD12025288,
ZINC75926109,
AKOS022178204,
DS-8072,
1-(2-Amino-6-fluoro-phenyl)-ethanone,
Ethanone, 1-(2-amino-6-fluorophenyl)-,
AK145194,
AJ-122108,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.156g/mol |
| Monoisotopic Mass | 153.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number