Biphenyl-Polyethylene-Glycol-Polymer-2 | SBID = 254 | 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: | C102H189NO46 | ||
| M / g/mol: | 2165.6 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: aromatic, typical guest
- Name: Biphenyl-Polyethylene-Glycol-Polymer-2
- Preferred Abbreviation: Biphenyl-polyethylene-glycol 2
- IUPAC Name:
- CAS:
- CID: -32
- InChiKey: AKGJADJBABOUDN-UHFFFAOYSA-N
- InChi: InChI=1S/C102H189NO46/c1-105-11-12-106-13-14-107-15-16-108-17-18-109-19-20-110-21-22-111-23-24-112-25-26-113-27-28-114-29-30-115-31-32-116-33-34-117-35-36-118-37-38-119-39-40-120-41-42-121-43-44-122-45-46-123-47-48-124-49-50-125-51-52-126-53-54-127-55-56-128-57-58-129-59-60-130-61-62-131-63-64-132-65-66-133-67-68-134-69-70-135-71-72-136-73-74-137-75-76-138-77-78-139-79-80-140-81-82-141-83-84-142-85-86-143-87-88-144-89-90-145-91-92-146-93-94-147-95-96-148-97-98-149-102(104)103-101-9-7-100(8-10-101)99-5-3-2-4-6-99/h2-10H,11-98H2,1H3,(H,103,104)
- CanoSmiles: O=C(NC1=CC=C(C=C1)C2=CC=CC=C2)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC
- IsoSmiles: O=C(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)NC1=CC=C(C2=CC=CC=C2)C=C1
