2-(4,5-Dihydro-2-oxazolyl)quinoline

• Catalog Number: ACM202191126-1
• Product Name: 2-(4,5-Dihydro-2-oxazolyl)quinoline
• CAS: 202191-12-6
• Category: Heterocyclic Organic Compound
• Synonyms: 2-(Quinolin-2-yl)-4,5-dihydrooxazole
• IUPAC Name: 2-quinolin-2-yl-4,5-dihydro-1,3-oxazole
• Molecular Weight: 198.22
• Molecular Formula: C12H10N2O
• Canonical SMILES: C1COC(=N1)C2=NC3=CC=CC=C3C=C2
• InChI: USDSJWOYSHFPND-UHFFFAOYSA-N
• InChI Key: InChI=1S/C12H10N2O/c1-2-4-10-9(3-1)5-6-11(14-10)12-13-7-8-15-12/h1-6H,7-8H2
• Boiling Point: 380.2±15.0 °C(Predicted)
• Melting Point: 109-110 °C
• Complexity: 264
• Covalently-Bonded Unit Count: 1
• Exact Mass: 198.079312947
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 0
• Monoisotopic Mass: 198.079312947
• Rotatable Bond Count: 1
• Topological Polar Surface Area: 34.5 Ų