(S)-2-(Boc-aminomethyl)pyrrolidine - CAS 141774-70-1
Catalog: |
BB009235 |
Product Name: |
(S)-2-(Boc-aminomethyl)pyrrolidine |
CAS: |
141774-70-1 |
Synonyms: |
N-[[(2S)-2-pyrrolidinyl]methyl]carbamic acid tert-butyl ester; tert-butyl N-[[(2S)-pyrrolidin-2-yl]methyl]carbamate |
IUPAC Name: | tert-butyl N-[[(2S)-pyrrolidin-2-yl]methyl]carbamate |
Description: | (S)-2-(Boc-aminomethyl)pyrrolidine (CAS# 141774-70-1) is a useful research chemical. |
Molecular Weight: | 200.28 |
Molecular Formula: | C10H20N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1CCCN1 |
InChI: | InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-8-5-4-6-11-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m0/s1 |
InChI Key: | DPJPFGHHTJLWQQ-QMMMGPOBSA-N |
Boiling Point: | 303.9 °C at 760 mmHg |
Density: | 0.997 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD06796572 |
LogP: | 1.98280 |
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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020079769-A1 | Thiadiazole irak4 compounds | 20180813 |
TW-202016115-A | Thiadiazole IRAK4 inhibitor | 20180813 |
CA-3105534-A1 | Thiadiazole irak4 inhibitors | 20180813 |
KR-20210044820-A | Thiadiazole IRAK4 inhibitor | 20180813 |
US-11046686-B2 | Thiadiazole IRAK4 compounds | 20180813 |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.152477885 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 50.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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