2-Chlorododecane

Base Information

• Chemical Name: 2-Chlorododecane
• CAS No.: 2350-11-0
• Deprecated CAS: 51191-26-5
• Molecular Formula: C12H25Cl
• Molecular Weight: 204.784
• Hs Code.: 2903199000
• European Community (EC) Number: 219-081-0
• UNII: 1228T7TD5O
• DSSTox Substance ID: DTXSID6021537
• Nikkaji Number: J190.806E
• Wikidata: Q27251361
• Mol file: 2350-11-0.mol

Synonyms:2-CHLORODODECANE;Dodecane, 2-chloro-;2350-11-0;1228T7TD5O;EINECS 219-081-0;2-chloro-dodecane;Dodecane,2-chloro-;UNII-1228T7TD5O;DTXSID6021537;SCHEMBL10454691;AKOS012769346;Q27251361

Chemical Property of 2-Chlorododecane

Chemical Property:

• Vapor Pressure: 0.025mmHg at 25°C
• Melting Point: -9.3°C (estimate)
• Refractive Index: 1.436
• Boiling Point: 256.2 °C at 760 mmHg
• Flash Point: 99.5 °C
• PSA: 0.00000
• Density: 0.859g/cm³
• LogP: 5.14450
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 9
• Exact Mass: 204.1644785
• Heavy Atom Count: 13
• Complexity: 91.1

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCC(C)Cl

Technology Process of 2-Chlorododecane

There total 13 articles about 2-Chlorododecane 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: 50.0%

(2,2-Dimethyl-1,1-diphenyl-propyl)-(1-methyl-undecyl)-diazene → 2-chlorododecane (2350-11-0)

Guidance literature:

With N-chloro-succinimide; In benzene; Heating;

DOI:10.1039/c39860000176

Reference yield:

dodecane (112-40-3) → 2-chlorododecane (2350-11-0) + 1,12-dichlorododecane (3922-28-9) + 1,2-dichlorododecane (75121-23-2) + 3-chlorododecane (2350-12-1) + 1-chlorododecane (112-52-7)

Guidance literature:

With zeolite LZ 105; chlorine; Product distribution; Mechanism; Irradiation; other 1-substituted alkanes;

DOI:10.1021/jo00251a012

Reference yield:

dodecane (112-40-3) → 2-chlorododecane (2350-11-0) + 1-chlorododecane (112-52-7)

Guidance literature:

With tetrachloromethane; manganese(III) acetylacetonate; acetonitrile; at 200 ℃; for 8h; Time; Sealed tube;

DOI:10.1134/S1070428013110018

upstream raw materials:

dodecane

trichloromethyl methyl sulfide

1-dodecene

rac-2-dodecanol

Downstream raw materials:

1-dodecene

dodec-2-ene

dodecane

Refernces

• 1、 Li, Zhengning,Crosignani, Stefano,Linclau, Bruno. "A mild, phosphine-free method for the conversion of alcohols into halides (Cl, Br, I) via the corresponding O-alkyl isoureas". . p. 8143 - 8147. Retrieved 2007/10/03.
• 2、 Baldwin, Jack E.,Adlington, Robert M.,Newington, Ian M.. "Azo Anions in Synthesis: α-Amino Carbanion Equivalents from t-Butyldiphenylmethylhydrazones". . p. 176 - 178. Retrieved 2007/10/02.