1-Boc-3-fluoro-3-(hydroxymethyl)piperidine - CAS 1209781-11-2
Catalog: |
BB005006 |
Product Name: |
1-Boc-3-fluoro-3-(hydroxymethyl)piperidine |
CAS: |
1209781-11-2 |
Synonyms: |
3-fluoro-3-(hydroxymethyl)-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 3-fluoro-3-(hydroxymethyl)piperidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-fluoro-3-(hydroxymethyl)piperidine-1-carboxylate |
Description: | 1-Boc-3-fluoro-3-(hydroxymethyl)piperidine (CAS# 1209781-11-2) is a useful research chemical. |
Molecular Weight: | 233.28 |
Molecular Formula: | C11H20FNO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC(C1)(CO)F |
InChI: | InChI=1S/C11H20FNO3/c1-10(2,3)16-9(15)13-6-4-5-11(12,7-13)8-14/h14H,4-8H2,1-3H3 |
InChI Key: | QBQOPNYILDXCBJ-UHFFFAOYSA-N |
LogP: | 1.65580 |
Publication Number | Title | Priority Date |
CA-3018275-A1 | Benzo[b]furans as bromodomain inhibitors | 20160407 |
CA-3018358-A1 | Pyridyl derivatives as bromodomain inhibitors | 20160407 |
EP-3440075-A1 | Benzo[b]furans as bromodomain inhibitors | 20160407 |
EP-3440075-B1 | Benzo[b]furans as bromodomain inhibitors | 20160407 |
JP-2019510782-A | Pyridyl Derivatives as Bromodomain Inhibitors | 20160407 |
Complexity: | 264 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.14272166 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.14272166 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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