| CAS Number | 1158721-58-4 |
| Catalog Number | AG01DV07 |
| Chemical Name | 2,2-Difluoro-3-(methylamino)propan-1-ol |
| IUPAC Name | 2,2-difluoro-3-(methylamino)propan-1-ol |
| InChI | InChI=1S/C4H9F2NO/c1-7-2-4(5,6)3-8/h7-8H,2-3H2,1H3 |
| InChI Key | KYJLTAKLJYWDLP-UHFFFAOYSA-N |
| MDL Number | MFCD19227443 |
| Molecular Formula | C4H9F2NO |
| Molecular Weight | 125.1172 |
| SMILES | FC(CO)(CNC)F |
| Synonyms | 2,2-difluoro-3-(methylamino)propan-1-ol,
1158721-58-4,
SCHEMBL4146415,
MFCD19227443,
AKOS006378160,
2,2-Difluoro-3-(methylamino)-1-propanol,
|
| Complexity | 67.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.119g/mol |
| Monoisotopic Mass | 125.065g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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Certificate of Analysis
Lot Number