2-(Di-t-butylphosphinomethyl)-6-(diethylaminomethyl)pyridine,98%
Product Information
Molecular Formula
C19H35N2P
Molecular Weight
322.47
Description
2-(Di-t-butylphosphinomethyl)-6-(diethylaminomethyl)pyridine,98% embodies a distinct pharmaceutical compound, routinely encompassed within antiviral drug formulations. It plays an important role in inhibiting viral replication and is primarily studied in pathological conditions such as hepatitis C and HIV.
Synonyms
PNN
IUPAC Name
N-[[6-(ditert-butylphosphanylmethyl)pyridin-2-yl]methyl]-N-ethylethanamine
SMILES
CCN(CC)CC1=NC(=CC=C1)CP(C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C19H35N2P/c1-9-21(10-2)14-16-12-11-13-17(20-16)15-22(18(3,4)5)19(6,7)8/h11-13H,9-10,14-15H2,1-8H3
InChI Key
MTBWGMDPQBSPGF-UHFFFAOYSA-N
Flash Point
154.0 °F
Density
0.936 g/mL at 25 °C
Refractive Index
n20/D 1.519
Safety Information
Hazards
H261 - H315 - H319 - H335 - H413
Precautionary Statement
P231 + P232 - P273 - P302 + P352 - P305 + P351 + P338
Computed Properties
XLogP3
3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
8
Exact Mass
322.25378612 g/mol
Monoisotopic Mass
322.25378612 g/mol
Topological Polar Surface Area
16.1Ų
Heavy Atom Count
22
Formal Charge
0
Complexity
298
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2021001240-A1 | Hydrogenation of esters to alcohols in the presence of a ru-pnn complex | 2019-07-03 |
| CN-114080379-A | Hydrogenation of esters to alcohols in the presence of Ru-PNN complexes | 2019-07-03 |
| WO-2020152200-A1 | Process for preparation of heteroarylketones | 2019-01-25 |
| WO-2019075004-A1 | SYNTHESIS OF BICYCLO [2.2.2] OCTANE DERIVATIVES | 2017-10-11 |
| EP-3694831-A1 | Synthesis of bicyclo[2.2.2]octane derivatives | 2017-10-11 |
| US-2020270191-A1 | Synthesis of bicyclo[2.2.2]octane derivatives | 2017-10-11 |
| WO-2018130011-A1 | Hydroformylation method and catalyst using rhodium-ruthenium bimetal and quadridentate phosphine ligand | 2017-01-12 |
| WO-2018103536-A1 | Reaction method and catalyst for internal olefin isomerization and hydroformylation | 2016-12-08 |
| EP-3256250-A1 | Phenanthroline based pincer complexes useful as catalysts for the preparation of methanol from carbondioxide | 2015-02-10 |
| EP-3256250-B1 | Phenanthroline based pincer complexes useful as catalysts for the preparation of methanol from carbondioxide | 2015-02-10 |
