5-Bromo-2-phenylpyridine

• CAS: 27012-25-5
• Catalog Number: ACM27012255-1
• Category: Bromine Series
• Molecular Weight: 234.09
• Molecular Formula: C11H8BrN
• Synonyms: 2-Phenyl-5-Bromopyridine
• IUPAC Name: 5-bromo-2-phenylpyridine
• Canonical SMILES: C1=CC=C(C=C1)C2=NC=C(C=C2)Br
• InChI: PRNGIODVYLTUKH-UHFFFAOYSA-N
• InChI Key: InChI=1S/C11H8BrN/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h1-8H
• Boiling Point: 309.3 °C at 760 mmHg
• Density: 1.426g/cm³
• Appearance: Solid
• Complexity: 154
• Covalently-Bonded Unit Count: 1
• Exact Mass: 232.98401g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 13
• Isomeric SMILES: C1=CC=C(C=C1)C2=NC=C(C=C2)Br
• Monoisotopic Mass: 232.98401g/mol
• Rotatable Bond Count: 1
• XLogP3: 3.2

Custom Q&A

What is the molecular formula of 5-Bromo-2-phenylpyridine?

The molecular formula of 5-Bromo-2-phenylpyridine is C11H8BrN.

What is the molecular weight of 5-Bromo-2-phenylpyridine?

The molecular weight of 5-Bromo-2-phenylpyridine is 234.09 g/mol.

What is the IUPAC name of 5-Bromo-2-phenylpyridine?

The IUPAC name of 5-Bromo-2-phenylpyridine is 5-bromo-2-phenylpyridine.

What is the InChI of 5-Bromo-2-phenylpyridine?

The InChI of 5-Bromo-2-phenylpyridine is InChI=1S/C11H8BrN/c12-10-6-7-11(13-8-10)9-4-2-1-3-5-9/h1-8H.

What is the InChIKey of 5-Bromo-2-phenylpyridine?

The InChIKey of 5-Bromo-2-phenylpyridine is PRNGIODVYLTUKH-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-2-phenylpyridine?

The canonical SMILES of 5-Bromo-2-phenylpyridine is C1=CC=C(C=C1)C2=NC=C(C=C2)Br.

What is the CAS number of 5-Bromo-2-phenylpyridine?

The CAS number of 5-Bromo-2-phenylpyridine is 27012-25-5.

What is the XLogP3-AA value of 5-Bromo-2-phenylpyridine?

The XLogP3-AA value of 5-Bromo-2-phenylpyridine is 3.2.

How many hydrogen bond donor counts does 5-Bromo-2-phenylpyridine have?

5-Bromo-2-phenylpyridine has 0 hydrogen bond donor counts.

How many rotatable bond counts does 5-Bromo-2-phenylpyridine have?

5-Bromo-2-phenylpyridine has 1 rotatable bond count.