8-Chloronaphthalene-1-thiol

Base Information

• Chemical Name: 8-Chloronaphthalene-1-thiol
• CAS No.: 61209-66-3
• Molecular Formula: C10H7 Cl S
• Molecular Weight: 194.685
• Hs Code.: 2930909090
• European Community (EC) Number: 262-659-2
• DSSTox Substance ID: DTXSID30210130
• Nikkaji Number: J268.416K
• Wikidata: Q83084691
• Mol file: 61209-66-3.mol

Synonyms:8-Chloronaphthalene-1-thiol;61209-66-3;1-Naphthalenethiol, 8-chloro-;EINECS 262-659-2;C10H7ClS;8-Chloro-1-naphthalenethiol;C10-H7-Cl-S;DTXSID30210130

Chemical Property of 8-Chloronaphthalene-1-thiol

Chemical Property:

• Vapor Pressure: 0.000442mmHg at 25°C
• Boiling Point: 325.2°C at 760 mmHg
• Flash Point: 133.3°C
• PSA: 38.80000
• Density: 1.314g/cm³
• LogP: 3.78190
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 193.9956991
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)S)C(=CC=C2)Cl

Technology Process of 8-Chloronaphthalene-1-thiol

There total 1 articles about 8-Chloronaphthalene-1-thiol 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:

chlorobenzene (108-90-7) → 8-chloro-1-naphthalenethiol (61209-66-3)

Guidance literature:

With phosphorus pentachloride; Behandeln des Reaktionsprodukts mit Zink und wss. H₂SO₄;

Reference yield:

8-chloro-1-naphthalenethiol (61209-66-3) → 8-(acetoxymethyl)-1-naphthyl methyl disulfide (118715-01-8)

Guidance literature:

Multi-step reaction with 2 steps

2: 94 percent / 4-(dimethylamino)pyridine / CH₂Cl₂ / 1 h / Ambient temperature

With dmap; In dichloromethane;

DOI:10.1021/jm00123a021

Reference yield:

8-chloro-1-naphthalenethiol (61209-66-3) → <8-(methyldithio)-1-naphthyl>methyl 8-amino-2,6-anhydro-3,8-dideoxy-D-glycero-D-talo-octonate (118715-08-5)

Guidance literature:

Multi-step reaction with 3 steps

2: 79 percent / N,N-bis(2-oxo-3-oxazolidinyl)phosphordiamidic chloride / tetrahydrofuran / 24 h / Ambient temperature

3: 40 percent / 2 N aq. trifluoroacetic acid / tetrahydrofuran / 72 h / Ambient temperature

With N,N-bis[2-oxo-3-oxazolidinyl]phosphorodiamidic chloride; trifluoroacetic acid; In tetrahydrofuran;

DOI:10.1021/jm00123a021

upstream raw materials:

chlorobenzene

Downstream raw materials:

2H-Naphtho<1,8-bc>thiophen

8-(acetoxymethyl)-1-naphthyl methyl disulfide

<8-(methyldithio)-1-naphthyl>methyl 8-amino-2,6-anhydro-3,8-dideoxy-D-glycero-D-talo-octonate