N-Boc-3,3-difluoropiperidin-4-one - CAS 1215071-17-2
Catalog: |
BB005184 |
Product Name: |
N-Boc-3,3-difluoropiperidin-4-one |
CAS: |
1215071-17-2 |
Synonyms: |
3,3-difluoro-4-oxo-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate |
IUPAC Name: | tert-butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate |
Description: | N-Boc-3,3-difluoropiperidin-4-one (CAS# 1215071-17-2) is a useful research chemical. |
Molecular Weight: | 235.23 |
Molecular Formula: | C10H15F2NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(=O)C(C1)(F)F |
InChI: | InChI=1S/C10H15F2NO3/c1-9(2,3)16-8(15)13-5-4-7(14)10(11,12)6-13/h4-6H2,1-3H3 |
InChI Key: | GDZBFUOJMJSIAZ-UHFFFAOYSA-N |
Appearance: | White to yellow solid |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD16140378 |
LogP: | 1.76950 |
Publication Number | Title | Priority Date |
WO-2021178920-A1 | Compounds for targeted degradation of brd9 | 20200305 |
WO-2021133809-A1 | Inhibitors of mutant forms of egfr | 20191223 |
WO-2021127561-A1 | Isoindolinone and indazole compounds for the degradation of egfr | 20191220 |
WO-2021126728-A1 | Prmt5 inhibitors | 20191217 |
WO-2021126729-A1 | Prmt5 inhibitors | 20191217 |
Complexity: | 310 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.10199966 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.10199966 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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