4-Propoxy-[1,1'-biphenyl]-4'-carbonitrile

• CAS: 52709-86-1
• Catalog Number: ACM52709861
• Category: Other Products
• Molecular Weight: 237.3g/mol
• Molecular Formula: C16H15NO
• Synonyms: 3OCB;4'-PROPOXY-BIPHENYL-4-CARBONITRILE;4-PROPOXY-4'-CYANOBIPHENYL;4-CYANO-4'-PROPYLOXYBIPHENYL;AKOS BAR-2141;1'-biphenyl)-4-carbonitrile,4'-propoxy-(;1'-biphenyl]-4-carbonitrile,4'-propoxy-[;1'-Biphenyl]-4-carbonitrile,4'-propoxy-[1
• IUPAC Name: 4-(4-propoxyphenyl)benzonitrile
• Canonical SMILES: CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
• InChI: InChI=1S/C16H15NO/c1-2-11-18-16-9-7-15(8-10-16)14-5-3-13(12-17)4-6-14/h3-10H,2,11H2,1H3
• InChI Key: RZCQJZFWJZHMPK-UHFFFAOYSA-N
• Density: 1.1 g/cm³
• Complexity: 277
• Covalently-Bonded Unit Count: 1
• EC Number: 258-122-7
• Exact Mass: 237.115364g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 18
• Monoisotopic Mass: 237.115364g/mol
• Rotatable Bond Count: 4
• XLogP3: 4.1