2-Bromo-3-iodo-4-picoline

• CAS: 884494-42-2
• Catalog Number: ACM884494422
• Category: Bromine Series
• Molecular Weight: 199
• Molecular Formula: C₆H₅BrIN
• Synonyms: 2-Bromo-3-iodo-4-methylpyridine, 2-Bromo-3-iodo-4-picoline, 884494-42-2, AG-H-56295, 88494-42-2, PubChem5911, CTK5F9820, MolPort-002-041-233, ANW-57451, Pyridine,2-bromo-3-iodo-4-methyl-, ZINC08698080, AKOS015891692, AK-87028, KB-21188, KB-68245, 2-BROMO-3-IODO-4-METHYL PYRIDINE, FT-0657970, ST51052490, A10511, I02-1696
• IUPAC Name: 2-bromo-3-iodo-4-methylpyridine
• Canonical SMILES: CC1=C(C(=NC=C1)Br)I
• InChI Key: QXDGAEFNHPQAJR-UHFFFAOYSA-N
• Boiling Point: 305.9ºC at 760 mmHg
• Flash Point: 138.8ºC
• Density: 2.171g/cm³
• Exact Mass: 296.86500
• H-Bond Acceptor: 1
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of 2-Bromo-3-iodo-4-picoline?

The molecular formula of 2-Bromo-3-iodo-4-picoline is C6H5BrIN.

What is the molecular weight of 2-Bromo-3-iodo-4-picoline?

The molecular weight of 2-Bromo-3-iodo-4-picoline is 297.92 g/mol.

What is the IUPAC name of 2-Bromo-3-iodo-4-picoline?

The IUPAC name of 2-Bromo-3-iodo-4-picoline is 2-bromo-3-iodo-4-methylpyridine.

What is the InChI code for 2-Bromo-3-iodo-4-picoline?

The InChI code for 2-Bromo-3-iodo-4-picoline is InChI=1S/C6H5BrIN/c1-4-2-3-9-6(7)5(4)8/h2-3H,1H3.

What is the InChIKey for 2-Bromo-3-iodo-4-picoline?

The InChIKey for 2-Bromo-3-iodo-4-picoline is QXDGAEFNHPQAJR-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Bromo-3-iodo-4-picoline?

The canonical SMILES of 2-Bromo-3-iodo-4-picoline is CC1=C(C(=NC=C1)Br)I.

What is the XLogP3-AA value of 2-Bromo-3-iodo-4-picoline?

The XLogP3-AA value of 2-Bromo-3-iodo-4-picoline is 2.9.

How many hydrogen bond donor counts does 2-Bromo-3-iodo-4-picoline have?

2-Bromo-3-iodo-4-picoline has 0 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-Bromo-3-iodo-4-picoline have?

2-Bromo-3-iodo-4-picoline has 1 hydrogen bond acceptor count.

How many rotatable bond counts does 2-Bromo-3-iodo-4-picoline have?

2-Bromo-3-iodo-4-picoline has 0 rotatable bond count.