(R)-4-Phenoxy-mandelonitrile

Base Information

• Chemical Name: (R)-4-Phenoxy-mandelonitrile
• CAS No.: 121986-00-3
• Molecular Formula: C14H11NO2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID501263181
• Nikkaji Number: J841.962K
• Mol file: 121986-00-3.mol

Synonyms:(R)-4-Phenoxy-mandelonitrile;121986-00-3;(2R)-2-hydroxy-2-(4-phenoxyphenyl)acetonitrile;DTXSID501263181;(alphaR)-alpha-Hydroxy-4-phenoxybenzeneacetonitrile

Chemical Property of (R)-4-Phenoxy-mandelonitrile

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 225.078978594
• Heavy Atom Count: 17
• Complexity: 269

Purity/Quality:

99% ^*data from raw suppliers

(R)-4-PHENOXY-MANDELONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)C(C#N)O
• Isomeric SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)[C@H](C#N)O

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