4-[Hydroxy(3-thienyl)methyl]benzonitrile

Base Information

• Chemical Name: 4-[Hydroxy(3-thienyl)methyl]benzonitrile
• CAS No.: 42296-09-3
• Molecular Formula: C12H9NOS
• DSSTox Substance ID: DTXSID70449669
• Nikkaji Number: J1.346.856G
• Mol file: 42296-09-3.mol

Synonyms:42296-09-3;4-[Hydroxy(3-thienyl)methyl]benzonitrile;AGN-PC-0NDFTN;DTXSID70449669

Chemical Property of 4-[Hydroxy(3-thienyl)methyl]benzonitrile

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 215.04048508
• Heavy Atom Count: 15
• Complexity: 252

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C#N)C(C2=CSC=C2)O

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