4-Isothiocyanato-4'-pentyl-1,1'-biphenyl

Base Information

• Chemical Name: 4-Isothiocyanato-4'-pentyl-1,1'-biphenyl
• CAS No.: 61592-86-7
• Molecular Formula: C18H19NS
• DSSTox Substance ID: DTXSID90601828
• Nikkaji Number: J1.168.166B

Synonyms:61592-86-7;SCHEMBL9347327;DTXSID90601828;4'-Isothiocyanato-4-pentyl-biphenyl;4'-pentyl-4-isothiocyanato-1,1'-biphenyl;4-ISOTHIOCYANATO-4'-PENTYL-1,1'-BIPHENYL

Chemical Property of 4-Isothiocyanato-4'-pentyl-1,1'-biphenyl

Chemical Property:

• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 281.12382078
• Heavy Atom Count: 20
• Complexity: 305

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)N=C=S

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