10-Chloro-3-decyne

Base Information

• Chemical Name: 10-Chloro-3-decyne
• CAS No.: 18295-64-2
• Molecular Formula: C10H17 Cl
• Molecular Weight: 172.698
• DSSTox Substance ID: DTXSID2066357
• Nikkaji Number: J422.019F
• Wikidata: Q81992956
• Mol file: 18295-64-2.mol

Synonyms:10-Chloro-3-decyne;18295-64-2;10-chlorodec-3-yne;3-Decyne, 10-chloro-;Chlorodecyne;97%;7-Decyn-1-yl Chloride;SCHEMBL4533070;DTXSID2066357;BQQIODGRFRSXTM-UHFFFAOYSA-;MFCD01321154;AKOS015850592;AS-57399;CS-0333791;FT-0637674;D89421

Chemical Property of 10-Chloro-3-decyne

Chemical Property:

• Refractive Index: 1.4620
• Boiling Point: 226.9°Cat760mmHg
• Flash Point: 86.3°C
• PSA: 0.00000
• Density: 0.917g/cm³
• LogP: 3.58910
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 5
• Exact Mass: 172.1018782
• Heavy Atom Count: 11
• Complexity: 126

Purity/Quality:

98%,99%, ^*data from raw suppliers

10-Chloro-3-decyne >97.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC#CCCCCCCCl

Technology Process of 10-Chloro-3-decyne

There total 1 articles about 10-Chloro-3-decyne 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:

→ 10-chloro-3-decyne (18295-64-2)

Guidance literature:

1-Chlor-7-octin-Na, Ethylbromid;

DOI:10.1007/BF02679241

Reference yield: 97.0%

10-chloro-3-decyne (18295-64-2) → decyl chloride (1002-69-3)

Guidance literature:

With ethanol; (^BQ?NC^OP)IrHCl; sodium t-butanolate; at 80 ℃; for 1.5h; Inert atmosphere; Schlenk technique; Sealed tube;

DOI:10.1021/jacs.8b01038

Reference yield:

10-chloro-3-decyne (18295-64-2) + trityl tetrafluoroborate (341-02-6) → C29H31Cl + C29H31Cl

Guidance literature:

With 2,4,6-trimethyl-pyridine; (1,2,3,4,5-pentamethylcyclopentadienyl)(tetrahydrofuran)dicarbonyliron(II) tetrafluoroborate; In 1,2-dichloro-ethane; at 60 ℃; for 48h; Overall yield = 45 percent; regioselective reaction;

DOI:10.1039/d0sc05091a

Downstream raw materials:

decyl chloride