2-Piperidinoethanol

Base Information

• Chemical Name: 2-Piperidinoethanol
• CAS No.: 3040-44-6
• Molecular Formula: C7H15NO
• Molecular Weight: 129.202
• Hs Code.: 29333999
• European Community (EC) Number: 221-244-6
• NSC Number: 3460
• UNII: VR81F07RX5
• DSSTox Substance ID: DTXSID4062808
• Nikkaji Number: J205.348I
• Wikidata: Q27130918
• Metabolomics Workbench ID: 61539
• ChEMBL ID: CHEMBL118227
• Mol file: 3040-44-6.mol

Synonyms:3040-44-6;2-Piperidinoethanol;1-(2-Hydroxyethyl)piperidine;1-PIPERIDINEETHANOL;2-(piperidin-1-yl)ethanol;N-(2-Hydroxyethyl)piperidine;N-Piperidineethanol;N-Piperidinoethanol;2-(1-Piperidinyl)ethanol;N-(Hydroxyethyl)piperidine;beta-Piperidylethanol;beta-Piperidinoethanol;2-(Piperidin-1-Yl)Ethan-1-Ol;.beta.-Piperidinoethanol;NSC 3460;2-piperidin-1-ylethanol;MFCD00006512;hydroxyethylpiperidine;1-piperidine ethanol;.beta.-Piperidylethanol;EINECS 221-244-6;2-Piperidin-1-yl-ethanol;1-Oxa-4-azaspiro(3.5)nonane (VAN);BRN 0103390;UNII-VR81F07RX5;AI3-11737;VR81F07RX5;CHEBI:61238;NSC-3460;5-20-02-00101 (Beilstein Handbook Reference);Piperidineethanol;1-piperidinethanol;NSC3460;piperidine-1-ethanol;2-piperidino-1-ethanol;2-(1-piperidyl)ethanol;SCHEMBL8564;(2-hydroxyethyl) piperidine;2-(piperidine-1-yl)ethanol;2-piperidin-1-ylethan-1-ol;N-(2-Hydroxyethyl) piperidine;2-(1-piperidinyl)-1-ethanol;CHEMBL118227;1-Oxa-4-azaspiro[3.5]nonane;DTXSID4062808;N-(beta-hydroxyethyl)-piperidine;Piperidine, 1-(2-hydroxyethyl);AMY9422;N-(.beta.-Hydroxyethyl)piperidine;(2-HYDROXY ETHYL)PIPERIDINE;BCP26656;AKOS000120091;CS-W013444;LF-0538;SB42932;SY009520;LS-115327;FT-0629150;FT-0673931;P0348;EN300-20588;D70541;W-106945;1-(2-Hydroxyethyl)piperidine, ReagentPlus(R), 99%;Q27130918;Z104479032;1-(2-Hydroxyethyl)piperidine, Vetec(TM) reagent grade, 98%

Chemical Property of 2-Piperidinoethanol

Chemical Property:

• Appearance/Colour: clear colourless liquid
• Vapor Pressure: 0.0802mmHg at 25°C
• Melting Point: 16 °C
• Refractive Index: n20/D 1.4804(lit.)
• Boiling Point: 200.5 °C at 760 mmHg
• PKA: 15.00±0.10(Predicted)
• Flash Point: 91.2 °C
• PSA: 23.47000
• Density: 0.974 g/cm³
• LogP: 0.40250
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Methanol (Slightly)
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 129.115364102
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99.0% ^*data from raw suppliers

PPOH ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)CCO
• Uses: 1-Piperidineethanol (cas# 3040-44-6) is a compound useful in organic synthesis.

Technology Process of 2-Piperidinoethanol

There total 38 articles about 2-Piperidinoethanol 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: 99.0%

piperidine (110-89-4) + 2-bromoethanol (540-51-2) → 1-piperidinoethanol (3040-44-6)

Guidance literature:

In dichloromethane; at 20 ℃; for 16h;

Reference yield: 96.0%

piperidin-1-yl-acetic acid ethyl ester (23853-10-3) → 1-piperidinoethanol (3040-44-6)

Guidance literature:

With C₃₀H₃₄Cl₂N₂P₂Ru; potassium methanolate; hydrogen; In tetrahydrofuran; at 100 ℃; for 5h; under 38002.6 - 76005.1 Torr; Glovebox; Autoclave;

Reference yield: 86.0%

methyl 2-piperidylacetate (58583-90-7) → 1-piperidinoethanol (3040-44-6)

Guidance literature:

With [carbonylchlorohydrido{bis[2-(diphenylphosphinomethyl)ethyl]amino}ethylamino] ruthenium(II); hydrogen; sodium methylate; In methanol; at 100 ℃; for 16h; under 37503.8 Torr; Autoclave; Inert atmosphere;

DOI:10.1021/op200234j

upstream raw materials:

oxirane

piperidine

2-chloro-ethanol

2-bromoethanol

Downstream raw materials:

chloro-phenyl-acetic acid-(2-piperidino-ethyl ester)

phenyl-acetic acid-(2-piperidino-ethyl ester)

phtalate acide de (piperidinyl)-2 ethanol

diphenyl-acetic acid-(2-piperidino-ethyl ester)

Refernces

• 1、 -. "Biquaternary ammonium compound, and preparation method and application thereof". Paragraph 0080-0083. . Retrieved 2021/06/13.
• 2、 -. "Diaminodiphosphine tetradentate ligand and ruthenium complex thereof, and preparation methods and applications of ligand and complex". Paragraph 0301-0303; 0306. . Retrieved 2019/11/04.