2-(Chloromethyl)-1-benzothiophene

Base Information

• Chemical Name: 2-(Chloromethyl)-1-benzothiophene
• CAS No.: 2076-88-2
• Molecular Formula: C9H7ClS
• Molecular Weight: 182.674
• Hs Code.: 2934999090
• European Community (EC) Number: 847-278-7
• DSSTox Substance ID: DTXSID10510524
• Nikkaji Number: J3.503.702K
• Wikidata: Q82368849
• Mol file: 2076-88-2.mol

Synonyms:2-(chloromethyl)-1-benzothiophene;2076-88-2;2-(Chloromethyl)benzo[b]thiophene;Benzo[b]thiophene, 2-(chloromethyl)-;2-chloromethyl-benzo[b]thiophene;2-chloromethyl benzothiophene;2-chloromethylbenzo[b]thiophene;SCHEMBL1522855;DTXSID10510524;JHDSVVPTMIYVGV-UHFFFAOYSA-N;MFCD08060638;AKOS005175060;AS-76603;BB 0262815;FT-0683974;D78699;EN300-126302

Chemical Property of 2-(Chloromethyl)-1-benzothiophene

Chemical Property:

• Melting Point: 44-45 °C
• Boiling Point: 129-131 °C(Press: 5 Torr)
• PSA: 28.24000
• Density: 1.298±0.06 g/cm3(Predicted)
• LogP: 3.64010
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 181.9956991
• Heavy Atom Count: 11
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

2-(Chloromethyl)-1-benzothiophene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(S2)CCl