| CAS Number | 1032251-82-3 |
| Catalog Number | AG01A4PK(AGN-PC-0WODCW) |
| Chemical Name | 6-fluoro-N,N-dimethylpyridine-3-carboxamide |
| IUPAC Name | 6-fluoro-N,N-dimethylpyridine-3-carboxamide |
| InChI | InChI=1S/C8H9FN2O/c1-11(2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3 |
| InChI Key | BPUDTWHLOMYSKZ-UHFFFAOYSA-N |
| MDL Number | MFCD19623921 |
| Molecular Formula | C8H9FN2O |
| Molecular Weight | 168.1683 |
| SMILES | CN(C(C1=CN=C(F)C=C1)=O)C |
| Synonyms | 6-fluoro-N,N-dimethylpyridine-3-carboxamide,
1032251-82-3,
3-Pyridinecarboxamide, 6-fluoro-N,N-dimethyl-,
SCHEMBL18921652,
ZINC69632186,
AKOS013289091,
NE35429,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.171g/mol |
| Monoisotopic Mass | 168.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number