1-Boc-3, 3-difluoro-4,4-(dihydroxy)piperidine - CAS 1067914-83-3
Catalog: |
BB061622 |
Product Name: |
1-Boc-3, 3-difluoro-4,4-(dihydroxy)piperidine |
CAS: |
1067914-83-3 |
Synonyms: |
tert-Butyl 3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate; 1-BOC-3, 3-DIFLUORO-4,4-(DIHYDROXY)PIPERIDINE; 1-Boc-3,3-difluoro-4,4-(dihydroxy)piperidine; 1-Boc-3; tert-butyl3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate |
IUPAC Name: | tert-butyl 3,3-difluoro-4,4-dihydroxypiperidine-1-carboxylate |
Description: | 1-Boc-3, 3-difluoro-4,4-(dihydroxy)piperidine |
Molecular Weight: | 253.24 |
Molecular Formula: | C10H17F2NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC(C(C1)(F)F)(O)O |
InChI: | InChI=1S/C10H17F2NO4/c1-8(2,3)17-7(14)13-5-4-10(15,16)9(11,12)6-13/h15-16H,4-6H2,1-3H3 |
InChI Key: | WQBMVRTXKYXMKT-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021061643-A1 | METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION | 20190923 |
CN-111377850-A | Chiral N-substituted-3, 3-difluoro-4-hydroxypiperidine derivative and preparation method thereof | 20181231 |
WO-2019214634-A1 | Erbb receptor inhibitors | 20180508 |
US-10822334-B2 | ErbB receptor inhibitors | 20180508 |
US-2020317669-A1 | Erbb receptor inhibitors | 20180508 |
US-2021009587-A1 | Erbb receptor inhibitors | 20180508 |
EP-3544610-A1 | Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders | 20161122 |
US-2019298725-A1 | Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders | 20161122 |
WO-2018098128-A1 | Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders | 20161122 |
US-11000526-B2 | Treatment of autism spectrum disorders, obsessive-compulsive disorder and anxiety disorders | 20161122 |
Complexity: | 312 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.11256435 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.11256435 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 70Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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