| CAS Number | 1224431-15-5 |
| Catalog Number | AG00A0N3 |
| Chemical Name | MFZ 10-7 |
| IUPAC Name | 3-fluoro-5-[2-(6-methylpyridin-2-yl)ethynyl]benzonitrile;hydrochloride |
| InChI | InChI=1S/C15H9FN2.ClH/c1-11-3-2-4-15(18-11)6-5-12-7-13(10-17)9-14(16)8-12;/h2-4,7-9H,1H3;1H |
| InChI Key | WRHOKQFFLQKKNL-UHFFFAOYSA-N |
| MDL Number | MFCD22683827 |
| Molecular Formula | C15H9FN2 |
| Molecular Weight | 236.2438 |
| SMILES | C(#N)C1=CC(C#CC2=NC(C)=CC=C2)=CC(F)=C1 |
| Synonyms | 3-fluoro-5-((6-methylpyridin-2-yl)ethynyl)benzonitrile,
MFZ 10-7,
MFZ 10-7,
1224431-15-5,
AKOS024458161,
3-Fluoro-5-[2-(6-methyl-2-pyridinyl)ethynyl]benzonitrile hydrochloride,
|
| Complexity | 397 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.707g/mol |
| Monoisotopic Mass | 272.052g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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