4-Bromo-3-fluoronitrobenzene

• CAS: 185331-69-5
• Catalog Number: ACM185331695
• Category: Bromine Series

Custom Q&A

What is the molecular formula of 4-Bromo-3-fluoronitrobenzene?

The molecular formula of 4-Bromo-3-fluoronitrobenzene is C6H3BrFNO2.

What is the IUPAC name of 4-Bromo-3-fluoronitrobenzene?

The IUPAC name of 4-Bromo-3-fluoronitrobenzene is 1-bromo-2-fluoro-4-nitrobenzene.

What is the InChI of 4-Bromo-3-fluoronitrobenzene?

The InChI of 4-Bromo-3-fluoronitrobenzene is InChI=1S/C6H3BrFNO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H.

What is the InChIKey of 4-Bromo-3-fluoronitrobenzene?

The InChIKey of 4-Bromo-3-fluoronitrobenzene is AZYQMHQOHNGPRR-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Bromo-3-fluoronitrobenzene?

The canonical SMILES of 4-Bromo-3-fluoronitrobenzene is C1=CC(=C(C=C1[N+](=O)[O-])F)Br.

What is the molecular weight of 4-Bromo-3-fluoronitrobenzene?

The molecular weight of 4-Bromo-3-fluoronitrobenzene is 220.00 g/mol.

What is the CAS number of 4-Bromo-3-fluoronitrobenzene?

The CAS number of 4-Bromo-3-fluoronitrobenzene is 185331-69-5.

What is the XLogP3-AA value of 4-Bromo-3-fluoronitrobenzene?

The XLogP3-AA value of 4-Bromo-3-fluoronitrobenzene is 2.5.

How many hydrogen bond donor counts does 4-Bromo-3-fluoronitrobenzene have?

4-Bromo-3-fluoronitrobenzene has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-Bromo-3-fluoronitrobenzene have?

4-Bromo-3-fluoronitrobenzene has 3 hydrogen bond acceptor counts.

Synthetic Use

Upstream Synthesis Route 1

• 1072-85-1

• 701-45-1
• 185331-69-5

Reference: [1] Journal of Organic Chemistry, 1998, vol. 63, # 23, p. 8448 - 8454
[2] Journal of Organic Chemistry, 1998, vol. 63, # 23, p. 8448 - 8454

Downstream Synthesis Route 1

• 185331-69-5

• 188975-15-7

Reference: [1] Patent: WO2014/26242, 2014, A1,

* For details of the synthesis route, please refer to the original source to ensure accuracy.