4-((1S)-1-Amino-2,2,2-trifluoroethyl)benzenecarbonitrile

Base Information

• Chemical Name: 4-((1S)-1-Amino-2,2,2-trifluoroethyl)benzenecarbonitrile
• CAS No.: 943816-46-4
• Molecular Formula: C9H7F3N2
• Molecular Weight: 200.16
• Mol file: 943816-46-4.mol

Synonyms:4-((1S)-1-AMINO-2,2,2-TRIFLUOROETHYL)BENZENECARBONITRILE;943816-46-4;(S)-4-(1-AMINO-2,2,2-TRIFLUOROETHYL)BENZONITRILE;4-[(1S)-1-AMINO-2,2,2-TRIFLUOROETHYL]BENZONITRILE;SCHEMBL14464991;IAHRECCKLMBEKX-QMMMGPOBSA-N;MFCD07374635;AKOS015924671;CS-0197722;F16843

Chemical Property of 4-((1S)-1-Amino-2,2,2-trifluoroethyl)benzenecarbonitrile

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 200.05613272
• Heavy Atom Count: 14
• Complexity: 232

Purity/Quality:

99% ^*data from raw suppliers

Benzonitrile,4-[(1S)-1-amino-2,2,2-trifluoroethyl]- 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C#N)C(C(F)(F)F)N
• Isomeric SMILES: C1=CC(=CC=C1C#N)[C@@H](C(F)(F)F)N

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