| CAS Number | 138999-34-5 |
| Catalog Number | AG01ACE3(AGN-PC-0MZ9WO) |
| Chemical Name | 2-fluoro-2-methylpropanenitrile |
| IUPAC Name | 2-fluoro-2-methylpropanenitrile |
| InChI | InChI=1S/C4H6FN/c1-4(2,5)3-6/h1-2H3 |
| InChI Key | REBAWHWWWIHOCJ-UHFFFAOYSA-N |
| MDL Number | MFCD18379826 |
| Molecular Formula | C4H6FN |
| Molecular Weight | 87.0955 |
| SMILES | CC(C#N)(F)C |
| Synonyms | 2-fluoro-2-methylpropanenitrile,
138999-34-5,
2-Fluoro-2-methylpropionitrile,
ZINC34278471,
AKOS006316141,
Z2731810781,
2-fluoro-2-methyl-propanenitrile,
CID10129896,
|
| Complexity | 87 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 87.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 87.097g/mol |
| Monoisotopic Mass | 87.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number