Biphenyl-polyethylene-glycol-polymer | SBID = 235 | Compound | Custom Molecule

Molecular Properties

Interactions: 2
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge:
Number of H-Bond Donors:
Number of H-Bond Acceptors:
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C106H197NO48
M / g/mol: 2253.7
Complexity:
Number of Conformers:

Identifiers

  • Tags: aromatic, typical guest
  • Name: Biphenyl-polyethylene-glycol-polymer
  • Preferred Abbreviation: Biphenyl-polyethylene glycol
  • IUPAC Name:
  • CAS:
  • CID: -21
  • InChiKey: VTYOBWRXROEWMO-UHFFFAOYSA-N
  • InChi: InChI=1S/C106H197NO48/c1-109-11-12-110-13-14-111-15-16-112-17-18-113-19-20-114-21-22-115-23-24-116-25-26-117-27-28-118-29-30-119-31-32-120-33-34-121-35-36-122-37-38-123-39-40-124-41-42-125-43-44-126-45-46-127-47-48-128-49-50-129-51-52-130-53-54-131-55-56-132-57-58-133-59-60-134-61-62-135-63-64-136-65-66-137-67-68-138-69-70-139-71-72-140-73-74-141-75-76-142-77-78-143-79-80-144-81-82-145-83-84-146-85-86-147-87-88-148-89-90-149-91-92-150-93-94-151-95-96-152-97-98-153-99-100-154-101-102-155-106(108)107-105-9-7-104(8-10-105)103-5-3-2-4-6-103/h2-10H,11-102H2,1H3,(H,107,108)
  • CanoSmiles: O=C(NC1=CC=C(C=C1)C2=CC=CC=C2)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC
  • IsoSmiles: O=C(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)NC1=CC=C(C2=CC=CC=C2)C=C1