5-Tetradecanol

Base Information

• Chemical Name: 5-Tetradecanol
• CAS No.: 21078-83-1
• Molecular Formula: C14H30O
• Molecular Weight: 214.392
• Hs Code.: 2905199090
• European Community (EC) Number: 244-196-8
• NSC Number: 158517
• DSSTox Substance ID: DTXSID901317291
• Nikkaji Number: J112.120K
• Mol file: 21078-83-1.mol

Synonyms:5-Tetradecanol;Tetradecan-5-ol;21078-83-1;NSC158517;SCHEMBL378754;DTXSID901317291;EINECS 244-196-8;AKOS014483579;NSC 158517;NSC-158517;AI3-35274

Chemical Property of 5-Tetradecanol

Chemical Property:

• Vapor Pressure: 0.000628mmHg at 25°C
• Refractive Index: 1.4237 (estimate)
• Boiling Point: 275.7°Cat760mmHg
• Flash Point: 110.4°C
• PSA: 20.23000
• Density: 0.832g/cm³
• LogP: 4.67820
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 214.229665576
• Heavy Atom Count: 15
• Complexity: 112

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC(CCCC)O

Technology Process of 5-Tetradecanol

There total 7 articles about 5-Tetradecanol 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: 72.0%

n-butyl magnesium bromide (693-03-8) + Methyl decanoate (110-42-9) → 5-tetradecanol (21078-83-1)

Guidance literature:

With zinc(II) tetrahydroborate; In tetrahydrofuran; at 20 ℃; for 0.5h;

DOI:10.1080/00397910008087324

Reference yield:

tetradecane (629-59-4) → 3-tetradecanol (1653-32-3,4476-77-1) + 1-Tetradecanol (112-72-1) + 6-tetradecanol (6836-39-1) + 5-tetradecanol (21078-83-1) + tetradecan-4-ol (1653-33-4) + tetradecan-2-ol (4706-81-4)

Guidance literature:

With iodosylbenzene; MnTTPPP(OAc); In benzene; at 25 ℃; for 7h; Mechanism; other catalysts and regioselectivity investigated;

DOI:10.1021/ja00283a024

Reference yield:

tetradecan-5-one (31857-89-3) → 5-tetradecanol (21078-83-1)

Guidance literature:

With ethanol; sodium;

DOI:10.1039/jr9570001701

upstream raw materials:

n-butyl magnesium bromide

caprinaldehyde

tetradecan-5-one

1-bromo-butane

Downstream raw materials:

tetradecan-5-one

Refernces

• 1、 Kishan Reddy,Periasamy. "Reaction of I2 with α-boraalkylmagnesium bromide: A new synthesis of mixed alkyl secondary alcohols". . p. 8877 - 8886. Retrieved 2007/10/02.
• 2、 Suslick, Kenneth,Cook, Bruce,Fox, Mary. "Shape-selective Alkane Hydroxylation". . p. 580 - 582. Retrieved 2007/10/02.