Ethyl 2-cyano-3-(2,6-dimethylanilino)-3-sulfanylprop-2-enoate

Base Information

• Chemical Name: Ethyl 2-cyano-3-(2,6-dimethylanilino)-3-sulfanylprop-2-enoate
• CAS No.: 648409-08-9
• Molecular Formula: C14H16N2O2S
• Molecular Weight: 276.35
• DSSTox Substance ID: DTXSID40409235
• Mol file: 648409-08-9.mol

Synonyms:ethyl 2-cyano-3-(2,6-dimethylanilino)-3-sulfanylprop-2-enoate;648409-08-9;DTXSID40409235

Chemical Property of Ethyl 2-cyano-3-(2,6-dimethylanilino)-3-sulfanylprop-2-enoate

Chemical Property:

• PSA: 100.92000
• LogP: 3.01638
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 276.09324893
• Heavy Atom Count: 19
• Complexity: 401

Purity/Quality:

ETHYL 2-CYANO-3-(2,6-DIMETHYLANILINO)-3-MERCAPTOACRYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=C(NC1=C(C=CC=C1C)C)S)C#N