2-Bromo-3-methylthiophene

• CAS: 14282-76-9
• Catalog Number: ACM14282769
• Category: Thiophenes
• Molecular Weight: 177.06g/mol
• Molecular Formula: C5H5BrS
• Synonyms: Thiophene, 2-bromo-3-methyl-
• IUPAC Name: 2-bromo-3-methylthiophene
• Canonical SMILES: CC1=C(SC=C1)Br
• InChI: InChI=1S/C5H5BrS/c1-4-2-3-7-5(4)6/h2-3H,1H3
• InChI Key: YYJBWYBULYUKMR-UHFFFAOYSA-N
• Boiling Point: 176.0 °C
• Flash Point: 68 °C
• Density: 1.572 g/mL at 25 °C(lit.)
• Appearance: Colorless Clear Liquid
• Complexity: 65.1
• Covalently-Bonded Unit Count: 1
• EC Number: 238-175-2
• Exact Mass: 175.92953g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 7
• Monoisotopic Mass: 175.92953g/mol
• Rotatable Bond Count: 0
• XLogP3: 3