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Home> Hot Product Listed A   > ALB-H03226768
921205-03-0 structure

ALB-H03226768

Iupac Name:3-[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine
CAS No.:921205-03-0
Molecular Weight:537.666
Molecular Formula:C10H20N2O3 (isomer)
Names and Identifiers
Synonyms

imidazo[1,2-a]pyridine-3-propanoic acid,b-(2-fluorophenyl)- KB-273528

Inchi
InChI=1S/C39H27N3/c1-7-28(34-13-4-16-40-25-34)19-31(10-1)37-22-38(32-11-2-8-29(20-32)35-14-5-17-41-26-35)24-39(23-37)33-12-3-9-30(21-33)36-15-6-18-42-27-36/h1-27H
InChkey
CINYXYWQPZSTOT-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC(=C1)C2=CC(=CC(=C2)C3=CC=CC(=C3)C4=CN=CC=C4)C5=CC=CC(=C5)C6=CN=CC=C6)C7=CN=CC=C7
Properties
Melting Point
195-200°C
Computational chemical data
  • Molecular Weight:537.666g/mol
  • Molecular Formula:C10H20N2O3
  • Compound Is Canonicalized:True
  • Exact Mass:537.22
  • Monoisotopic Mass:537.22
  • Complexity:697
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:38.7A^2
  • Heavy Atom Count:42
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB/AAAAAAAAAAAAAAAAAAAAAAAAAAA8ePGCAAAAAAAB/AAAHAAAAAAADADBGgQ8gJIIEACg AjBnRACCgCAxAiAI2CA4ZJgIIOLAkZGEIAhggADIyAcQgMAOgAACAAAAAAAAAAQAAAAAAAAAAAAA AA==
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  • Tel:86-027-51118241
  • Fax:86-027-87208412
  • Tel:+86-371- 55366292
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