Undecane-1,11-diol

Base Information

• Chemical Name: Undecane-1,11-diol
• CAS No.: 765-04-8
• Molecular Formula: C11H24O2
• Molecular Weight: 188.31
• Hs Code.: 2905399090
• European Community (EC) Number: 212-135-4
• NSC Number: 4030
• UNII: 7N48TVC43D
• DSSTox Substance ID: DTXSID50227301
• Nikkaji Number: J193.130J
• Wikidata: Q27225094
• Mol file: 765-04-8.mol

Synonyms:Undecane-1,11-diol;1,11-Undecanediol;765-04-8;C11H24O2;NSC-4030;EINECS 212-135-4;MFCD00041568;Undecylenalkohol;NSC4030;Undecamethylene glycol;1,11-dihydroxyundecane;SCHEMBL183377;7N48TVC43D;BDBM36274;DTXSID50227301;CHEBI:131330;NSC 4030;AKOS006274312;CS-W005218;DS-1400;SY019466;FT-0651850;Q27225094

Chemical Property of Undecane-1,11-diol

Chemical Property:

• Vapor Pressure: 2.92E-05mmHg at 25°C
• Melting Point: 62°C
• Refractive Index: 1.459
• Boiling Point: 318.7 °C at 760 mmHg
• PKA: 14.90±0.10(Predicted)
• Flash Point: 146.4 °C
• PSA: 40.46000
• Density: 0.918 g/cm³
• LogP: 2.48190
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 188.177630004
• Heavy Atom Count: 13
• Complexity: 74.2

Purity/Quality:

1,11-Undecanediol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCCCCO)CCCCCO
• Uses: 1,11-Undecanediol, n-alkanols, α,ω-n-alkanediols, and ω-chloro-α-alkanols has been used studied for antifungal property

Technology Process of Undecane-1,11-diol

There total 28 articles about Undecane-1,11-diol 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: 94.0%

10-Undecen-1-ol (112-43-6) → undecane-1,11-diol (765-04-8)

Guidance literature:

10-Undecen-1-ol; With sodium tetrahydroborate; ethyl iodide; In 1,2-dimethoxyethane; at 25 ℃; for 20h;

With dihydrogen peroxide; sodium hydroxide; In water; at 0 - 25 ℃; for 0.333333h; Solvent; Reagent/catalyst;

DOI:10.1016/j.tetlet.2021.152977

Reference yield: 93.0%

Methyl 10-undecenoate (111-81-9) → undecane-1,11-diol (765-04-8)

Guidance literature:

With zirconium(IV) borohydride; In tetrahydrofuran; at 25 ℃; for 2h;

DOI:10.1080/00397910008087061

Reference yield: 90.0%

undec-10-yn-1-ol (2774-84-7) → undecane-1,11-diol (765-04-8)

Guidance literature:

With formic acid; F₆P^(1-)*C₁₆H₂₂N₃Ru⁽¹⁺⁾; water; In 1-methyl-pyrrolidin-2-one; at 25 ℃; for 24h; Inert atmosphere; Sealed tube;

DOI:10.1021/ja501738a

upstream raw materials:

undeca-2,9-diene-1,11-diol

11-bromoundecanyl acetate

diethyl 1,11-undecanedicarboxylate

oxacyclododecan-2-one

Downstream raw materials:

1,4-dioxa-cyclopentadecane-2,3-dione

(11?hydroxyundecyl)triphenylphosphonium bromide

11-bromoundecanoic acid

11-mercaptounadecanoic acid

Refernces

• 1、 Luis-Raya, Gilgamesh,Ramírez-Cardona, Màrius,Luna-Bárcenas, Gabriel,Hernández-Landaverde, Martín A.,Jiménez-Nieto, Adair,García-Rivas, Jose Luis,Espa A-Sánchez, Beatriz Liliana,Sanchez, Isaac C.. "From intermolecular interactions to texture in polycrystalline surfaces of 1,ω-alkanediols (ω = 10–13)". . . Retrieved 2017/06/28.
• 2、 Li, Le,Herzon, Seth B.. "Temporal separation of catalytic activities allows anti-Markovnikov reductive functionalization of terminal alkynes". . p. 22 - 27. Retrieved 2014/01/17.