4-Hexyl-4-[2-(4-isothiocyanatophenyl)ethyl]-1,1-biphenyl

• CAS: 110499-97-3
• Catalog Number: ACM110499973
• Category: Organic & Printed Electronics
• Molecular Weight: 399.59
• Molecular Formula: C₂₇H₂₉NS
• Synonyms: 4-HEXYL-4-[2-(4-ISOTHIOCYANATOPHENYL)ETHYL]-1,1-BIPHENYL;4-hexyl-4-(2-(4-isothiocyanatophenyl)-ethyl)-1,1
• IUPAC Name: 1-hexyl-4-[4-[2-(4-isothiocyanatophenyl)ethyl]phenyl]benzene
• Canonical SMILES: CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC3=CC=C(C=C3)N=C=S
• InChI Key: KXHHFPNEPTUIEF-UHFFFAOYSA-N
• Boiling Point: 532.3ºC at 760 mmHg
• Flash Point: 302ºC
• Density: 1.01g/cm³
• Exact Mass: 399.20200
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Safety Description: 26-37/39