5-Chloro-alpha-(hydroxyimino)thiophen-2-acetonitrile

Base Information

• Chemical Name: 5-Chloro-alpha-(hydroxyimino)thiophen-2-acetonitrile
• CAS No.: 42520-76-3
• Molecular Formula: C6H3ClN2OS
• Molecular Weight: 186.61882
• European Community (EC) Number: 255-866-4
• Mol file: 42520-76-3.mol

Synonyms:EINECS 255-866-4;5-Chloro-alpha-(hydroxyimino)thiophen-2-acetonitrile;2-Thiopheneacetonitrile, 5-chloro-alpha-(hydroxyimino)-;C6H3ClN2OS;42520-76-3;C6-H3-Cl-N2-O-S;2-Thiopheneacetonitrile, 5-chloro-.alpha.-(hydroxyimino)-

Chemical Property of 5-Chloro-alpha-(hydroxyimino)thiophen-2-acetonitrile

Chemical Property:

• Boiling Point: 341.692oC at 760 mmHg
• Flash Point: 160.45oC
• PSA: 84.62000
• Density: 1.516g/cm3
• LogP: 2.10338
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 185.9654616
• Heavy Atom Count: 11
• Complexity: 222

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(SC(=C1)Cl)C(=NO)C#N
• Isomeric SMILES: C1=C(SC(=C1)Cl)/C(=N/O)/C#N