3-Methyl-2-phenylpyridine

• Catalog Number: ACM10273902-2
• Product Name: 3-Methyl-2-phenylpyridine
• CAS: 10273-90-2
• Category: Pyridines
• Synonyms: 2-Phenyl-β-picoline
• IUPAC Name: 3-methyl-2-phenylpyridine
• Molecular Weight: 169.22
• Molecular Formula: C12H11N
• Canonical SMILES: CC1=C(N=CC=C1)C2=CC=CC=C2
• InChI: BJATUPPYBZHEIO-UHFFFAOYSA-N
• InChI Key: InChI=1S/C12H11N/c1-10-6-5-9-13-12(10)11-7-3-2-4-8-11/h2-9H,1H3
• Boiling Point: 160 °C
• Melting Point: 167-172 °C
• Flash Point: 96 °C
• Density: 1.065 g/cm³ at 25 °C
• Appearance: Brown liqiud
• Complexity: 149
• Covalently-Bonded Unit Count: 1
• EC Number: 233-619-1
• Exact Mass: 169.089149g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 13
• Isomeric SMILES: CC1=C(N=CC=C1)C2=CC=CC=C2
• Monoisotopic Mass: 169.089149g/mol
• NSC Number: 26784
• Rotatable Bond Count: 1
• UNII: OIY9I0GL3Z
• XLogP3: 2.9