4-Bromo-2-chloro-6-fluorophenol

• CAS: 161045-79-0
• Catalog Number: ACM161045790
• Category: Bromine Series
• Molecular Weight: 225.44
• Molecular Formula: C₆H₃BrClFO
• Synonyms: 4-Bromo-2-chloro-6-fluorophenol, ZINC02382135, JRD-1193, CID2773270, 161045-79-0
• IUPAC Name: 4-bromo-2-chloro-6-fluorophenol
• Canonical SMILES: C1=C(C=C(C(=C1Cl)O)F)Br
• InChI Key: QEYONPKSDTUPAX-UHFFFAOYSA-N
• Boiling Point: 212.5ºC at 760mmHg
• Flash Point: 82.3ºC
• Density: 1.875g/cm³
• Exact Mass: 223.90400
• Hazard Statements: Xi:Harmful
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Safety Description: S26

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C6H3BrClFO.

What is the molecular weight of the compound?

The molecular weight of the compound is 225.44 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 4-bromo-2-chloro-6-fluorophenol.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C6H3BrClFO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H.

What is the InChIKey of the compound?

The InChIKey of the compound is QEYONPKSDTUPAX-UHFFFAOYSA-N.

What is the CAS number of the compound?

The CAS number of the compound is 161045-79-0.

What is the European Community (EC) number of the compound?

The European Community (EC) number of the compound is 670-795-2.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 2 hydrogen bond acceptor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.