Carbamic acid, (((cyanomethyl)(4-methylphenyl)amino)thio)methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester

Base Information

• Chemical Name: Carbamic acid, (((cyanomethyl)(4-methylphenyl)amino)thio)methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
• CAS No.: 82560-70-1
• Molecular Formula: C21H23N3O3S
• Molecular Weight: 397.49
• DSSTox Substance ID: DTXSID50231867
• Wikidata: Q83112854
• Mol file: 82560-70-1.mol

Synonyms:82560-70-1;Carbamic acid, (((cyanomethyl)(4-methylphenyl)amino)thio)methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester;DTXSID50231867;LS-49195

Chemical Property of Carbamic acid, (((cyanomethyl)(4-methylphenyl)amino)thio)methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester

Chemical Property:

• Vapor Pressure: 5.72E-12mmHg at 25°C
• Boiling Point: 545.8°C at 760 mmHg
• Flash Point: 283.9°C
• PSA: 91.10000
• Density: 1.26g/cm³
• LogP: 4.73248
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 397.14601278
• Heavy Atom Count: 28
• Complexity: 597

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)N(CC#N)SN(C)C(=O)OC2=CC=CC3=C2OC(C3)(C)C