1-(5-Bromo-2-fluorophenyl)ethanone

• CAS: 198477-89-3
• Catalog Number: ACM198477893
• Category: Bromine Series
• Molecular Weight: 217.04
• Molecular Formula: C8H6 Br F O
• Synonyms: 1-(5-bromo-2-fluorophenyl)ethanone, 198477-89-3, 5-Bromo-2-fluoroacetophenone, 1-acetyl-5-bromo-2-fluorobenzene, SBB068707, 1-(5-Bromo-2-fluorophenyl)-1-ethanone, Ethanone, 1-(5-bromo-2-fluorophenyl)-, PubChem16430, SureCN10082, ACMC-1C1DO, KSC169G7H, CTK0G9373, ANW-23827, ZINC31893423, AKOS005073820, AB64047, AG-E-45057, LS10106, MCULE-4535033939, QC-7736
• IUPAC Name: 1-(5-bromo-2-fluorophenyl)ethanone
• Canonical SMILES: CC(=O)C1=C(C=CC(=C1)Br)F
• InChI Key: XNRQIHIOKXQSPG-UHFFFAOYSA-N
• Boiling Point: 251.017ºC at 760 mmHg
• Flash Point: 105.612ºC
• Density: 1.535g/cm³
• Exact Mass: 215.95900
• H-Bond Acceptor: 2
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of the compound with PubChem CID 22607476?

The molecular formula is C8H6BrFO.

What is the molecular weight of the compound?

The molecular weight is 217.03 g/mol.

What are some synonyms for the compound?

Some synonyms include 5'-Bromo-2'-fluoroacetophenone and 1-(5-Bromo-2-fluorophenyl)-1-ethanone.

What is the IUPAC name of the compound?

The IUPAC name is 1-(5-bromo-2-fluorophenyl)ethanone.

What is the InChIKey of the compound?

The InChIKey is XNRQIHIOKXQSPG-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 17.1Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

How many defined bond stereocenter counts does the compound have?

The compound has 0 defined bond stereocenter counts.

What is the complexity of the compound?

The complexity of the compound is 160.