Biphenyl-polyethylene-glycol-polymer | SBID = 235 | 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: | 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
