1-Boc-3-(aminomethyl)-3-fluoropiperidine - CAS 1219832-36-6
Catalog: |
BB005318 |
Product Name: |
1-Boc-3-(aminomethyl)-3-fluoropiperidine |
CAS: |
1219832-36-6 |
Synonyms: |
3-(aminomethyl)-3-fluoro-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 3-(aminomethyl)-3-fluoropiperidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-(aminomethyl)-3-fluoropiperidine-1-carboxylate |
Description: | 1-Boc-3-(aminomethyl)-3-fluoropiperidine (CAS# 1219832-36-6) is a useful research chemical. |
Molecular Weight: | 232.30 |
Molecular Formula: | C11H21FN2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC(C1)(CN)F |
InChI: | InChI=1S/C11H21FN2O2/c1-10(2,3)16-9(15)14-6-4-5-11(12,7-13)8-14/h4-8,13H2,1-3H3 |
InChI Key: | QLSJCALZHFNFAL-UHFFFAOYSA-N |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
LogP: | 2.32250 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2019233425-A1 | Gcn2 inhibitors and uses thereof | 20180129 |
WO-2019148132-A1 | Gcn2 inhibitors and uses thereof | 20180129 |
AU-2019211485-A1 | GCN2 inhibitors and uses thereof | 20180129 |
CN-111918651-A | GCN2 inhibitors and uses thereof | 20180129 |
EP-3746075-A1 | Gcn2 inhibitors and uses thereof | 20180129 |
Complexity: | 265 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.15870608 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.15870608 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Amines and Anilines
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