1-Chloro-1,2,3,4-tetrahydronaphthalene

Base Information

• Chemical Name: 1-Chloro-1,2,3,4-tetrahydronaphthalene
• CAS No.: 58485-68-0
• Molecular Formula: C10H11Cl
• Molecular Weight: 166.65
• European Community (EC) Number: 611-664-1
• DSSTox Substance ID: DTXSID60921000
• Nikkaji Number: J1.970.239A
• Mol file: 58485-68-0.mol

Synonyms:1-chloro-1,2,3,4-tetrahydronaphthalene;113110-47-7;58485-68-0;chlorotetralin;Naphthalene, 1-chloro-1,2,3,4-tetrahydro-;1-chlorotetralin;C10H11Cl;1,2,3,4-tetrahydro-1-chloronaphthalene;SCHEMBL926062;DTXSID60921000;MFCD10694921;AKOS000321794;AKOS016050284;CS-0248736;EN300-41210;(+/-)-1-chloro-1,2,3,4-tetrahydronaphthalene;J-002895;F8880-5922

Chemical Property of 1-Chloro-1,2,3,4-tetrahydronaphthalene

Chemical Property:

• PSA: 29.46000
• LogP: 2.09960
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 166.0549280
• Heavy Atom Count: 11
• Complexity: 133

Purity/Quality:

99.9% ^*data from raw suppliers

1-chloro-1,2,3,4-tetrahydronaphthalene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(C2=CC=CC=C2C1)Cl

Technology Process of 1-Chloro-1,2,3,4-tetrahydronaphthalene

There total 2 articles about 1-Chloro-1,2,3,4-tetrahydronaphthalene 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: 87.0%

1,2,3,4-Tetrahydro-1-naphthol (529-33-9) → 1,2-Dihydronaphthalene (447-53-0) + 1-chlorotetralin (58485-68-0)

Guidance literature:

With tetrachlorosilane; In chloroform; at 20 ℃; for 5h;

DOI:10.1081/SCC-120025175

Reference yield:

tetralin (119-64-2) → naphthalene (91-20-3,71998-51-1,72931-45-4) + 1,2-Dihydronaphthalene (447-53-0) + 1-chlorotetralin (58485-68-0) + 1,2-dichloro-1,2,3,4-tetrahydronaphthalene (31448-63-2,53589-37-0) + C10H10Cl2 + 3,4-dihydronaphthalene-1(2H)-one (529-34-0)

Guidance literature:

With 1,1,8,8,22,22,29,29-octamethyl-1,8,22,29-tetraazonia<8.1.8.1>paracyclophane tetrachloride; chlorine; In water; Product distribution; Irradiation; var. of reagents;

Reference yield: 79.0%

1-chlorotetralin (58485-68-0) + potassium cyanide (151-50-8) → 1-cyanotetraline (132205-64-2,56536-96-0)

Guidance literature:

With 18-crown-6 ether; In acetonitrile; for 5h; Heating;

DOI:10.1002/ardp.19893221210

upstream raw materials:

tetralin

1,2,3,4-Tetrahydro-1-naphthol

Downstream raw materials:

2,4-Dimethyl-2-(1,2,3,4-tetrahydro-1-naphthyl)-3-pentanon

Phenyl-<1,2,3,4-tetrahydro-naphthyl-(1)>-malonsaeure-diaethylester

2-(1,2,3,4-Tetrahydro-1-naphthyl)-1-cyclohexanon

1-cyanotetraline

Refernces

• 1、 Firouzabadi, Habib,Iranpoor, Naser,Karimi, Babak,Hazarkhani, Hassan. "Silica Chloride (SiO2-Cl), a New Heterogeneous Reagent, for the Selective and Efficient Conversion of Benzylic Alcohols to Their Corresponding Chlorides and Iodides". . p. 3671 - 3677. Retrieved 2007/10/03.