2-Propenenitrile, 3,3-bis(methylthio)-

Base Information

• Chemical Name: 2-Propenenitrile, 3,3-bis(methylthio)-
• CAS No.: 51245-80-8
• Molecular Formula: C5H7NS2
• Molecular Weight: 145.249
• DSSTox Substance ID: DTXSID10416012
• Nikkaji Number: J2.464.177E
• Mol file: 51245-80-8.mol

Synonyms:51245-80-8;3,3-bis(methylthio)acrylonitrile;2-Propenenitrile, 3,3-bis(methylthio)-;3,3-bis(methylsulfanyl)prop-2-enenitrile;SCHEMBL1059784;HFVCCDWVYQHTNK-UHFFFAOYSA-;DTXSID10416012;HFVCCDWVYQHTNK-UHFFFAOYSA-N;3,3-Bis(methylthio)propenenitrile;3,3-bis(methylsulfanyl)acrylonitrile;3,3-Bis-methylsulfanyl-acrylonitrile;3,3-bis(methylsulfanyl)-acrylonitrile;3,3-Bis(methylthio)-2-propenenitrile;InChI=1/C5H7NS2/c1-7-5(8-2)3-4-6/h3H,1-2H3

Chemical Property of 2-Propenenitrile, 3,3-bis(methylthio)-

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 145.00199157
• Heavy Atom Count: 8
• Complexity: 125

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC(=CC#N)SC