N,N-Diallylcyanothioformamide

Base Information

• Chemical Name: N,N-Diallylcyanothioformamide
• CAS No.: 178811-54-6
• Molecular Formula: C8H10 N2 S
• Molecular Weight: 166.24
• DSSTox Substance ID: DTXSID60449153
• Nikkaji Number: J734.552F
• Wikidata: Q82268531
• Mol file: 178811-54-6.mol

Synonyms:178811-54-6;N,N-Diallylcyanothioformamide;1-cyano-N,N-bis(prop-2-enyl)methanethioamide;Carbonocyanidothioic amide, di-2-propenyl- (9CI);Carbonocyanidothioicamide, di-2-propenyl- (9CI);DTXSID60449153;N,N-diallyl-1-cyano-thioformamide;3-[allyl(cyanocarbothioyl)amino]-1-propene

Chemical Property of N,N-Diallylcyanothioformamide

Chemical Property:

• Boiling Point: 223.4±43.0 °C(Predicted)
• PKA: -0.18±0.50(Predicted)
• PSA: 59.12000
• Density: 1.062±0.06 g/cm3(Predicted)
• LogP: 1.51138
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 166.05646950
• Heavy Atom Count: 11
• Complexity: 201

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCN(CC=C)C(=S)C#N