| CAS Number | 1662681-20-0 |
| Catalog Number | AG01C4N5 |
| Chemical Name | tert-butyl N-(4,4-difluoro-1-hydroxybutan-2-yl)carbamate |
| IUPAC Name | tert-butyl N-(4,4-difluoro-1-hydroxybutan-2-yl)carbamate |
| InChI | InChI=1S/C9H17F2NO3/c1-9(2,3)15-8(14)12-6(5-13)4-7(10)11/h6-7,13H,4-5H2,1-3H3,(H,12,14) |
| InChI Key | FIGRNQDEWAYPRM-UHFFFAOYSA-N |
| MDL Number | MFCD29763200 |
| Molecular Formula | C9H17F2NO3 |
| Molecular Weight | 225.2330 |
| SMILES | CC(OC(NC(CC(F)F)CO)=O)(C)C |
| Synonyms | 1662681-20-0,
tert-butyl N-(4,4-difluoro-1-hydroxybutan-2-yl)carbamate,
tert-butyl N-[3,3-difluoro-1-(hydroxymethyl)propyl]carbamate,
AKOS033634828,
Z1864179688,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.236g/mol |
| Monoisotopic Mass | 225.118g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number