4-(3-Methoxyphenyl)benzonitrile

Base Information

• Chemical Name: 4-(3-Methoxyphenyl)benzonitrile
• CAS No.: 154848-39-2
• Molecular Formula: C14H11NO
• Molecular Weight: 209.24
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID40402468
• Nikkaji Number: J1.753.828D
• Wikidata: Q82205882
• Mol file: 154848-39-2.mol

Synonyms:4-(3-methoxyphenyl)benzonitrile;154848-39-2;3'-Methoxy-[1,1'-biphenyl]-4-carbonitrile;3'-Methoxy[1,1'-biphenyl]-4-carbonitrile;SCHEMBL7629793;DTXSID40402468;3'-Methoxybiphenyl-4-carbonitrile;MFCD06801995;AKOS004117713;BS-25213;BB 0223009;3/'-METHOXY[1,1/'-BIPHENYL]-4-CARBONITRILE

Chemical Property of 4-(3-Methoxyphenyl)benzonitrile

Chemical Property:

• Boiling Point: 362.0±25.0 °C(Predicted)
• PSA: 33.02000
• Density: 1.14±0.1 g/cm3(Predicted)
• LogP: 3.23388
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 209.084063974
• Heavy Atom Count: 16
• Complexity: 259

Purity/Quality:

4-(3-Methoxyphenyl)benzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)C2=CC=C(C=C2)C#N