2-Bromo-6-(trifluoromethyl)pyridine

• CAS: 189278-27-1
• Catalog Number: ACM189278271
• Category: Bromine Series
• Molecular Weight: 225.99
• Molecular Formula: C₆H₃NBrF₃
• Synonyms: 2-Bromo-6-(trifluoromethyl)pyridine, 189278-27-1, 2-Bromo-6-trifluoromethylpyridine, 2-bromo-6-trifluoromethyl-pyridine, 6-bromo-2-(trifluoromethyl)pyridine, SBB054360, AG-E-38175, Pyridine, 2-bromo-6-(trifluoromethyl)-, ZINC02526214, PubChem9307, ACMC-209esf, AC1MD3AV, KSC495O4T, 661147_ALDRICH, CTK3J5749, MolPort-000-146-710, 2-Bromo-6-trifluoromethylpyridine;, ACT01354, ANW-23437, WT2015
• IUPAC Name: 2-bromo-6-(trifluoromethyl)pyridine
• SMILES: C1=CC(=NC(=C1)Br)C(F)(F)F
• InChI Key: DOWNSQADAFSSAR-UHFFFAOYSA-N
• Boiling Point: 78-79ºC 14mm
• Melting Point: 49-50ºC
• Flash Point: 57ºC
• Density: 1.707g/cm³
• Appearance: beige moist crystals
• Exact Mass: 224.94000
• Hazard Statements: Xn:Harmful
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Safety Description: S22-S26-S36/37/39
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 2-Bromo-6-(trifluoromethyl)pyridine?

The molecular formula is C6H3BrF3N.

When was the PubChem CID for 2-Bromo-6-(trifluoromethyl)pyridine created and last modified?

The CID was created on 2005-07-19 and last modified on 2023-12-02.

What is the IUPAC name of 2-Bromo-6-(trifluoromethyl)pyridine?

The IUPAC name is 2-bromo-6-(trifluoromethyl)pyridine.

What is the InChIKey of 2-Bromo-6-(trifluoromethyl)pyridine?

The InChIKey is DOWNSQADAFSSAR-UHFFFAOYSA-N.

What is the Canonical SMILES representation of 2-Bromo-6-(trifluoromethyl)pyridine?

The Canonical SMILES is C1=CC(=NC(=C1)Br)C(F)(F)F.

What is the molecular weight of 2-Bromo-6-(trifluoromethyl)pyridine?

The molecular weight is 225.99 g/mol.

How many hydrogen bond acceptors are there in 2-Bromo-6-(trifluoromethyl)pyridine?

There are four hydrogen bond acceptors in the compound.

What is the topological polar surface area of 2-Bromo-6-(trifluoromethyl)pyridine?

The topological polar surface area is 12.9Ų.

How many defined atom stereocenters are present in 2-Bromo-6-(trifluoromethyl)pyridine?

There are zero defined atom stereocenters in the compound.

Is 2-Bromo-6-(trifluoromethyl)pyridine a canonicalized compound?

Yes, the compound is canonicalized according to PubChem.