1-(2-Benzothiazolyl)-4-bromobenzene

• CAS: 19654-19-4
• Catalog Number: ACM19654194
• Category: Other Products
• Molecular Weight: 290.18g/mol
• Molecular Formula: C13H8BrNS
• IUPAC Name: 2-(4-bromophenyl)-1,3-benzothiazole
• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)Br
• InChI: InChI=1S/C13H8BrNS/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H
• InChI Key: FQIRBKKYMJKENC-UHFFFAOYSA-N
• Complexity: 240
• Covalently-Bonded Unit Count: 1
• Exact Mass: 288.95608g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 16
• Monoisotopic Mass: 288.95608g/mol
• Rotatable Bond Count: 1
• XLogP3: 5