3,3',5,5'-Tetrabromo-1,1'-biphenyl

• CAS: 16400-50-3
• Catalog Number: ACM16400503-2
• Category: Alcohols
• Molecular Weight: 469.79
• Molecular Formula: C12H6Br4
• Synonyms: 1,3-Dibromo-5-phenylbenzene
• IUPAC Name: 1,3-dibromo-5-(3,5-dibromophenyl)benzene
• Canonical SMILES: C1=C(C=C(C=C1Br)Br)C2=CC(=CC(=C2)Br)Br
• InChI: InChI=1S/C12H6Br4/c13-9-1-7(2-10(14)5-9)8-3-11(15)6-12(16)4-8/h1-6H
• InChI Key: FXJXZYWFJAXIJX-UHFFFAOYSA-N
• Boiling Point: 185-190 °C
• Melting Point: 401.8 ± 40.0 °C
• Density: 2.140 ± 0.06 g/ml
• Appearance: Dark gray solid
• Complexity: 189
• Covalently-Bonded Unit Count: 1
• Exact Mass: 469.7162g/mol
• Formal Charge: 0
• Hazard Statements: H302-H317-H319-H412
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 16
• Monoisotopic Mass: 465.7203g/mol
• RIDADR: UN 3152PSN1 9 / PGII
• Rotatable Bond Count: 1
• Symbol: GHS07
• UNII: 4G4R89X711
• XLogP3: 6.3

Custom Q&A

What is the molecular formula of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The molecular formula is C12H6Br4.

What is the molecular weight of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The molecular weight is 469.79 g/mol.

What are the synonyms for 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The synonyms are 16400-50-3, 3,3',5,5'-Tetrabromobiphenyl, 1,1'-Biphenyl, 3,3',5,5'-tetrabromo-, and more.

What is the IUPAC name of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The IUPAC name is 1,3-dibromo-5-(3,5-dibromophenyl)benzene.

What is the InChI of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The InChI is InChI=1S/C12H6Br4/c13-9-1-7(2-10(14)5-9)8-3-11(15)6-12(16)4-8/h1-6H.

What is the InChIKey of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The InChIKey is FXJXZYWFJAXIJX-UHFFFAOYSA-N.

What is the canonical SMILES of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The canonical SMILES is C1=C(C=C(C=C1Br)Br)C2=CC(=CC(=C2)Br)Br.

What is the CAS number of 3,3',5,5'-Tetrabromo-1,1'-biphenyl?

The CAS number is 16400-50-3.

How many rotatable bonds does 3,3',5,5'-Tetrabromo-1,1'-biphenyl have?

It has 1 rotatable bond.