1-Chlorodecane

Base Information

• Chemical Name: 1-Chlorodecane
• CAS No.: 1002-69-3
• Molecular Formula: C10H21Cl
• Molecular Weight: 176.73
• Hs Code.: 29031980
• European Community (EC) Number: 213-691-0
• NSC Number: 6088
• UNII: L0HSC44E5X
• DSSTox Substance ID: DTXSID5027352
• Nikkaji Number: J1.755H
• Wikidata: Q27282551
• ChEMBL ID: CHEMBL3185190
• Mol file: 1002-69-3.mol

Synonyms:1-chlorodecane

Chemical Property of 1-Chlorodecane

Chemical Property:

• Appearance/Colour: clear almost colorless liquid
• Vapor Pressure: 0.141mmHg at 25°C
• Melting Point: -34 °C
• Refractive Index: n20/D 1.437(lit.)
• Boiling Point: 223.7 °C at 760 mmHg
• Flash Point: 83.3 °C
• PSA: 0.00000
• Density: 0.862 g/cm³
• LogP: 4.36590
• Storage Temp.: -20°C
• Solubility.: 0.01g/l
• Water Solubility.: 0.01 g/L (20 ºC)
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 8
• Exact Mass: 176.1331784
• Heavy Atom Count: 11
• Complexity: 61.9

Purity/Quality:

99.0% ^*data from raw suppliers

1-Chlorodecane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, Xi,N
• Hazard Codes: Xn,N,Xi
• Statements: 40-50/53-38-66
• Safety Statements: 24-36/37-60-61-37-46

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCl
• Uses: 1-Chlorodecane is used as a chemical intermediate.

Technology Process of 1-Chlorodecane

There total 40 articles about 1-Chlorodecane 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: 96.0%

1-Decanol (112-30-1) → decyl chloride (1002-69-3)

Guidance literature:

With Amberlite IRA 93 (PCl₅ form); In cyclohexane; for 4h; Heating;

DOI:10.1055/s-1983-30314

Reference yield: 93.0%

n-decyl chloroformate (55488-51-2) → decyl chloride (1002-69-3)

Guidance literature:

With N,N-dimethyl-formamide; at 100 - 110 ℃;

DOI:10.1021/jo00163a047

Reference yield: 92.0%

4-decylmorpholine (25727-94-0) → decyl chloride (1002-69-3)

Guidance literature:

With phenyl chloroformate; In benzene; Heating;

DOI:10.1016/S0040-4039(00)95746-0

upstream raw materials:

3-chloropropyl p-toluenesulfonate

diethyl ether

n-heptylmagnesium bromide

decane

Downstream raw materials:

N-decylpyridinium chloride

n-decyl acetate

undecanenitrile

1-aminodecane

Refernces

• 1、 Cooper,Urfer. "". . p. 337. Retrieved 1964.
• 2、 Reichart, Benedikt,Tekautz, Guenter,Kappe, C. Oliver. "Continuous flow synthesis of n-alkyl chlorides in a high-temperature microreactor environment". . p. 152 - 157. Retrieved 2013.
• 3、 Lam, Kevin,Mark, István E.. "Electrochemical deoxygenation of primary alcohols". . p. 1235 - 1239. Retrieved 2012.
• 4、 Asinger et al.. "-". . p. 3085,3099. Retrieved 1959.
• 5、 Regen, Steven L.,Mehrotra, Ashok,Singh, Alok. "Poly(acrylamide)-Based Solid-Phase Cosolvents". . p. 2182 - 2184. Retrieved 1981.
• 6、 Cahiez, Gérard,Chaboche, Christophe,Jézéquel, Michelle. "Cu-catalyzed alkylation of Grignard reagents: A new efficient procedure". . p. 2733 - 2737. Retrieved 2000.
• 7、 Hiegel, Gene A.,Rubino, Mark. "Conversion of alcohols into alkyl chlorides using trichloroisocyanuric acid with triphenylphosphine". . p. 2691 - 2694. Retrieved 2002.
• 8、 Ferreri,Costantino,Chatgilialoglu,Boukherroub,Manuel. "The versatile behavior of the PdCl2/Et3SiH system. Conversion of alcohols to the corresponding halides and alkanes". . p. 135 - 137. Retrieved 1998.
• 9、 Tarkhanova, Irina,Zelikman, Vladimir,Gantman, Mikhail. "The complexes of copper with grafted ionic liquids in the environmentally important processes". . p. 81 - 88. Retrieved 2014.
• 10、 Li, Xiang,Jin, Jianbo,Chen, Pinhong,Liu, Guosheng. "Catalytic remote hydrohalogenation of internal alkenes". . p. 425 - 432. Retrieved 2022/02/07.