2-Formyl-6-methoxybenzonitrile

Base Information

• Chemical Name: 2-Formyl-6-methoxybenzonitrile
• CAS No.: 21962-51-6
• Molecular Formula: C9H7NO2
• Molecular Weight: 161.16
• DSSTox Substance ID: DTXSID60604780
• Wikidata: Q82502802
• Mol file: 21962-51-6.mol

Synonyms:2-FORMYL-6-METHOXYBENZONITRILE;21962-51-6;2-CYANO-3-METHOXYBENZALDEHYDE;starbld0044391;SCHEMBL11362731;DTXSID60604780;MFCD10699535;AKOS006304875;MB08892;EN300-6493758;Z1198279618

Chemical Property of 2-Formyl-6-methoxybenzonitrile

Chemical Property:

• PSA: 50.09000
• LogP: 1.37938
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 161.047678466
• Heavy Atom Count: 12
• Complexity: 206

Purity/Quality:

2-Formyl-6-methoxybenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1C#N)C=O