4-Piperidineethanol

Base Information

• Chemical Name: 4-Piperidineethanol
• CAS No.: 622-26-4
• Molecular Formula: C7H15NO
• Molecular Weight: 129.202
• Hs Code.: 29333990
• European Community (EC) Number: 210-727-7
• NSC Number: 93818
• UNII: VRR3T9QR54
• DSSTox Substance ID: DTXSID8060749
• Nikkaji Number: J208.903C
• Wikidata: Q72500402
• ChEMBL ID: CHEMBL1651433
• Mol file: 622-26-4.mol

Synonyms:4-Piperidineethanol;622-26-4;2-(Piperidin-4-yl)ethanol;4-(2-Hydroxyethyl)piperidine;2-piperidin-4-ylethanol;2-(piperidin-4-yl)ethan-1-ol;4-Piperidine ethanol;4-hydroxyethyl-piperidine;piperidine-4-ethanol;2-(4-piperidyl)ethanol;4-Ethanolpiperidine;MFCD00006008;VRR3T9QR54;2-(piperidin-4-yl)-1-ethanol;EINECS 210-727-7;NSC 93818;NSC-93818;4-piperadinethanol;4-piperdineethanol;4-Piperidinethanol;NSC93818;4-piperdine ethanol;4-piperidin ethanol;4-piperidin-ethanol;4-piperidine-ethanol;4-hydroxyethylpiperidine;4-hydroxyethyl piperidine;2-(4-piperidinyl)ethanol;2-(4-piperidyl)-ethanol;2-piperidin-4-yl-ethanol;4-(hydroxyethyl)piperidine;UNII-VRR3T9QR54;4-Piperidineethanol, 97%;4-(2-hydroxyethyl)piperdine;SCHEMBL28281;2-(piperidin-4-yl)-ethanol;2-(4-piperidinyl)ethan-1-ol;4-(2'-hydroxyethyl)piperidine;4-(2-hydroxy-ethyl)piperidine;4-(2-hydroxyethyl) piperidine;4-(2-hydroxyethyl)-piperidine;CHEMBL1651433;DTXSID8060749;AKOS005265093;CS-W013445;LF-0537;SB42960;BP-12533;SY002532;BB 0220627;FT-0616542;P0992;EN300-71267;F11198;A833654;W-105030;F0001-1659;Z336087886

Chemical Property of 4-Piperidineethanol

Chemical Property:

• Appearance/Colour: white crystalline low melting solid
• Vapor Pressure: 0.0144mmHg at 25°C
• Melting Point: 46-47 °C(lit.)
• Refractive Index: n20/D 1.4902(lit.)
• Boiling Point: 228.3 °C at 760 mmHg
• PKA: 15.10±0.10(Predicted)
• Flash Point: 101.7 °C
• PSA: 32.26000
• Density: 0.939 g/cm³
• LogP: 0.69720
• Storage Temp.: 2-8°C
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 129.115364102
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99.9% ^*data from raw suppliers

4-Piperidineethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CNCCC1CCO
• Uses: Reactant for synthesis of:? ;Ursolic acid derivatives1? ;Amodiaquine analogues for treatment of cerebral malaria2? ;Spiroimidazolidinone NPC1L1 inhibitors3? ;Piperazinyl glutamate pyridines as orally bioavailable P2Y12 antagonists for inhibition of platelet aggregation4? ;Neurokinin-2 receptor antagonists5? ;Hepatitis C virus NS5B polymerase inhibitors6 4-Piperidineethanol have been used as a intermediate in the synthetic preparation of cellular-active allosteric inhibitors of FAK 4-Piperidineethanol have been used as an intermediate in the synthetic preparation of cellular-active allosteric inhibitors of FAK

Technology Process of 4-Piperidineethanol

There total 8 articles about 4-Piperidineethanol 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: 64.0%

4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl-amine (383865-57-4) → 4-(2-Hydroxyethyl)piperidine (622-26-4) + 4-(2-Hydroxy-ethyl)-piperidine-1-carboxylic acid (4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-amide

Guidance literature:

Reference yield: 62.5%

4-piperidinylacetic acid (51052-78-9) → 4-(2-Hydroxyethyl)piperidine (622-26-4)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 25 ℃; Cooling with ice; Inert atmosphere;

Reference yield:

1-t-Butoxycarbonyl-4-(methoxycarbonylmethyl)piperidine (175213-46-4) → 4-(2-Hydroxyethyl)piperidine (622-26-4)

Guidance literature:

With carbonylhydrido(tetrahydroborato)[bis(2-diphenylphosphinoethyl)-amino]ruthenium(II); hydrogen; sodium methylate; In methanol; at 100 ℃; for 12h; under 38002.6 Torr; Reagent/catalyst;

DOI:10.1021/acs.oprd.0c00301

upstream raw materials:

4-(2-hydroxyethyl)pyridine

pyridine-4-acetic acid

2-(1,2,3,6-tetrahydro-[4]pyridyl)-ethanol

acetic acid

Downstream raw materials:

Quinuclidine

4-(2-chloroethyl)piperidine hydrochloride

1-<3-Phenothiazinyl-(10)-propyl>-4-<2-hydroxy-aethyl>-piperidin.

N-formyl-4-(2-hydroxyethyl)piperidine

Refernces

• 1、 -. "With anti-platelet aggregation activity of the piperidinyl substituted 5- hydroxy color acid derivatives". Paragraph 0099; 0100. . Retrieved 2017/02/09.
• 2、 -. "Benzothiazole derivatives with activity as adenosine receptor ligands". . . Retrieved 2008/06/13.