2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile

Base Information

• Chemical Name: 2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile
• CAS No.: 438218-65-6
• Molecular Formula: C15H16N2S
• Molecular Weight: 256.37
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20350054
• Wikidata: Q82125775
• Mol file: 438218-65-6.mol

Synonyms:2-amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile;438218-65-6;2-amino-4-[4-(2-methylpropyl)phenyl]thiophene-3-carbonitrile;ZINC00034144;Oprea1_583968;DTXSID20350054;BBL017946;MFCD02854983;STK502475;AKOS000305086;VS-06607;CS-0315965;FT-0678526

Chemical Property of 2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile

Chemical Property:

• Vapor Pressure: 1.93E-07mmHg at 25°C
• Boiling Point: 425.3°C at 760 mmHg
• Flash Point: 211°C
• PSA: 78.05000
• Density: 1.16g/cm³
• LogP: 4.64868
• Storage Temp.: 2-8°C
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 256.10341969
• Heavy Atom Count: 18
• Complexity: 312

Purity/Quality:

98%min ^*data from raw suppliers

2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC1=CC=C(C=C1)C2=CSC(=C2C#N)N