3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine

Base Information

• Chemical Name: 3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine
• CAS No.: 34562-31-7
• Deprecated CAS: 852826-01-8
• Molecular Formula: C18H25N
• Molecular Weight: 255.403
• Hs Code.: 2933399090
• European Community (EC) Number: 252-091-3
• UNII: BZ2006225R
• DSSTox Substance ID: DTXSID2044923
• Nikkaji Number: J250.919I
• Wikidata: Q27274975
• ChEMBL ID: CHEMBL3181932
• Mol file: 34562-31-7.mol

Synonyms:34562-31-7;3,5-DIETHYL-1-PHENYL-2-PROPYL-1,2-DIHYDROPYRIDINE;3,5-Diethyl-1,2-dihydro-1-phenyl-2-propylpyridine;3,5-diethyl-1-phenyl-2-propyl-2H-pyridine;Pyridine, 3,5-diethyl-1,2-dihydro-1-phenyl-2-propyl-;DTXSID2044923;UNII-BZ2006225R;EINECS 252-091-3;BZ2006225R;1-Phenyl-3,5-diethyl-2-propyl-1,2-dihydropyridine;3,5-Diethyl-1,2-dihydro-1-phenyl-2-n-propylpyridine;PDHP;VANAX 808HP;SCHEMBL951980;CHEMBL3181932;DTXCID0024923;Tox21_301339;MFCD00071789;NCGC00256067-01;CAS-34562-31-7;CS-0132327;FT-0614726;J-511312;n-phenyl-2-propyl-3,5-diethyl-1,2-dihydropyridine;n-phenyl-3,5-diethyl-2-propyl-1,2-dihydropyridine;3,5-diethyl-1,2-dihydro-1-phenyl-2-propyl pyridine;Q27274975;Pyridine, 3,5-diethyl-1,2-dihydro-1-phenyl-2-propyl;3,5-DIETHYL-N-PHENYL-2-PROPYL-1,2-DIHYDROPYRIDINE;3,5-diethyl-1,2-dihydro-1-phenyl-2-propylpyridine, AldrichCPR

Chemical Property of 3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine

Chemical Property:

• Vapor Pressure: 2.42E-05mmHg at 25°C
• Refractive Index: 1.518
• Boiling Point: 359.2 °C at 760 mmHg
• PKA: 0.85±0.70(Predicted)
• Flash Point: 154.3 °C
• PSA: 3.24000
• Density: 0.934 g/cm³
• LogP: 5.37060
• Storage Temp.: 2-8°C
• Water Solubility.: 53.23μg/L at 25℃
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 255.198699802
• Heavy Atom Count: 19
• Complexity: 334

Purity/Quality:

98%, ^*data from raw suppliers

3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 21/22-36/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCC1C(=CC(=CN1C2=CC=CC=C2)CC)CC
• Recent ClinicalTrials: In Vivo Efficacy of Artemether-Lumefantrine, Amodiaquine-Artesunate, Dihydroartemisinin-Piperaquine, and Pironaridine-Artesunate in Mozambique
• Uses: 3,5-DIETHYL-1,2-DIHYDRO-1-PHENYL-2-PROPYLPYRIDINE is a useful research chemical.

Technology Process of 3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine

There total 4 articles about 3,5-Diethyl-1-phenyl-2-propyl-1,2-dihydropyridine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 59.0%

butyraldehyde (123-72-8) + aniline (62-53-3) → 3,5-diethyl-1-phenyl-2-propyl-1,2-dihydro-pyridine (34562-31-7)

Guidance literature:

butyraldehyde; aniline; With acetic acid; at 20 - 75 ℃; for 6h; Heating / reflux;

With sodium carbonate; In water; for 5h; Product distribution / selectivity; Heating / reflux;

Reference yield:

butyraldehyde (123-72-8) + aniline (62-53-3) → 2-ethylhexenal (645-62-5) + 3,5-diethyl-1-phenyl-2-propyl-1,2-dihydro-pyridine (34562-31-7)

Guidance literature:

With acetic acid; at 20 - 90 ℃; for 5 - 10h; Product distribution / selectivity; Heating / reflux;

Reference yield:

aniline (62-53-3) → 3,5-diethyl-1-phenyl-2-propyl-1,2-dihydro-pyridine (34562-31-7)

Guidance literature:

With acetic acid; butyraldehyde;

DOI:10.1021/ja01184a094

upstream raw materials:

aniline

water

acetic acid

butyraldehyde

Downstream raw materials:

3,5-diethyl-1-phenyl-2-propyl-pyridinium; iodide

Refernces