1-Bromo-2-fluoro-4-iodobenzene

• CAS: 136434-77-0
• Catalog Number: ACM136434770
• Category: Bromine Series
• Molecular Weight: 300.8966
• Molecular Formula: C6H3BrFI
• Synonyms: 2-Fluoro-4-iodobromobenzene
• IUPAC Name: 1-bromo-2-fluoro-4-iodobenzene
• Canonical SMILES: C1=CC(=C(C=C1I)F)Br
• InChI: InChI=1S/C6H3BrFI/c7-5-2-1-4(9)3-6(5)8/h1-3H
• InChI Key: OCODJNASCDFXSR-UHFFFAOYSA-N
• Melting Point: 34-38 ºC (lit.)
• Density: 2.269 g/ml
• Complexity: 99.1
• Covalently-Bonded Unit Count: 1
• Exact Mass: 299.84469g/mol
• Formal Charge: 0
• Hazard Statements: H315-H319-H335
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 9
• MDL Number: MFCD00042577
• Monoisotopic Mass: 299.84469g/mol
• RIDADR: NONH for all modes of transport
• Rotatable Bond Count: 0
• Size: 25g,100g
• Symbol: GHS07
• XLogP3: 3.4

Custom Q&A

What is the molecular formula of 1-Bromo-2-fluoro-4-iodobenzene?

The molecular formula is C6H3BrFI.

What is the molecular weight of 1-Bromo-2-fluoro-4-iodobenzene?

The molecular weight is 300.89 g/mol.

What is the IUPAC name of 1-Bromo-2-fluoro-4-iodobenzene?

The IUPAC name is 1-bromo-2-fluoro-4-iodobenzene.

What is the InChI of 1-Bromo-2-fluoro-4-iodobenzene?

The InChI is InChI=1S/C6H3BrFI/c7-5-2-1-4(9)3-6(5)8/h1-3H.

What is the InChIKey of 1-Bromo-2-fluoro-4-iodobenzene?

The InChIKey is OCODJNASCDFXSR-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Bromo-2-fluoro-4-iodobenzene?

The canonical SMILES is C1=CC(=C(C=C1I)F)Br.

What is the CAS number of 1-Bromo-2-fluoro-4-iodobenzene?

The CAS number is 136434-77-0.

What is the European Community (EC) number of 1-Bromo-2-fluoro-4-iodobenzene?

The European Community (EC) number is 626-381-9.

What is the DSSTox Substance ID of 1-Bromo-2-fluoro-4-iodobenzene?

The DSSTox Substance ID is DTXSID60369327.

Is 1-Bromo-2-fluoro-4-iodobenzene a covalently-bonded unit?

Yes, 1-Bromo-2-fluoro-4-iodobenzene is a covalently-bonded unit.