Dibenzofuran-polyethylene-glycol-polymer-2 | SBID = 250 | Compound | Custom Molecule
Structure
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: | C103H189NO48 | ||
| M / g/mol: | 2209.6 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: aromatic, typical guest
- Name: Dibenzofuran-polyethylene-glycol-polymer-2
- Preferred Abbreviation: Dibenzofuran-polyethylene-glycol 2
- IUPAC Name:
- CAS:
- CID: -29
- InChiKey: JHNJSUXCKRJDES-UHFFFAOYSA-N
- InChi: InChI=1S/C103H189NO48/c1-106-11-12-110-17-18-113-23-24-116-29-30-119-35-36-122-41-42-125-43-44-126-45-46-127-47-48-128-49-50-129-51-52-130-53-54-131-55-56-132-58-60-134-64-66-137-70-72-140-76-78-143-82-84-146-88-90-149-96-150-95-148-89-87-145-83-81-142-77-75-139-71-69-136-65-63-133-59-57-123-39-37-120-33-31-117-27-25-114-21-19-111-15-13-108-9-5-6-10-109-14-16-112-20-22-115-26-28-118-32-34-121-38-40-124-61-62-135-67-68-138-73-74-141-79-80-144-85-86-147-91-92-151-103(105)104-99-94-101-98(93-102(99)107-2)97-7-3-4-8-100(97)152-101/h3-4,7-8,93-94H,5-6,9-92,95-96H2,1-2H3,(H,104,105)
- CanoSmiles: O=C(NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCOCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC
- IsoSmiles: O=C(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCOCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)NC1=C(OC)C=C2C3=CC=CC=C3OC2=C1
