Tetrabromothiophene

• CAS: 3958-03-0
• Catalog Number: ACM3958030
• Category: Thiophenes
• Molecular Weight: 399.73g/mol
• Molecular Formula: C4Br4S
• Synonyms: 2,3,4,5-Tetrabromothiophene; Thiophene, tetrabromo-
• IUPAC Name: 2,3,4,5-tetrabromothiophene
• Canonical SMILES: C1(=C(SC(=C1Br)Br)Br)Br
• InChI: InChI=1S/C4Br4S/c5-1-2(6)4(8)9-3(1)7
• InChI Key: AVPWUAFYDNQGNZ-UHFFFAOYSA-N
• Boiling Point: 326.0 °C
• Melting Point: 117.5 °C
• Flash Point: 147.1°C
• Density: 2.782 g/cm³ at 25 °C(lit.)
• Complexity: 96.7
• Covalently-Bonded Unit Count: 1
• EC Number: 223-554-7
• Exact Mass: 399.64132g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 9
• Monoisotopic Mass: 395.64542g/mol
• NSC Number: 65427
• Rotatable Bond Count: 0
• XLogP3: 5