Benzo[b]thiophene-2-carbonylchloride, 3-chloro-

• Catalog Number: ACM21815918
• Product Name: Benzo[b]thiophene-2-carbonylchloride, 3-chloro-
• CAS: 21815-91-8
• Category: Heterocyclic Organic Compound
• IUPAC Name: 3-chloro-1-benzothiophene-2-carbonyl chloride
• Molecular Weight: 231.1g/mol
• Molecular Formula: C9H4Cl2OS
• Canonical SMILES: C1=CC=C2C(=C1)C(=C(S2)C(=O)Cl)Cl
• InChI: InChI=1S/C9H4Cl2OS/c10-7-5-3-1-2-4-6(5)13-8(7)9(11)12/h1-4H
• InChI Key: GWKSSMDJEWPKCM-UHFFFAOYSA-N
• Complexity: 222
• Covalently-Bonded Unit Count: 1
• Exact Mass: 229.935991g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 13
• Monoisotopic Mass: 229.935991g/mol
• Rotatable Bond Count: 1
• XLogP3: 4.4