2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL
TL;DR: 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL (CAS 98563-97-4) is a chemical compound with molecular formula C17H8Cl10O2 and molecular weight 593.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,6,7,8,9,10,10-decachloro-5-phenylmethoxypentacyclo[5.3.0.02,6.03,9.04,8]decan-5-ol
Also Known As: 2-(BENZYLOXY)-DECACHLORO-OCTAHYDRO-1,3,4-METHENO-2H-CYCLOBUTA(CD)PENTALEN-2-OL, 661-017-2, RefChem:459781
| Molecular Formula | C17H8Cl10O2 |
|---|---|
| Molecular Weight | 593.74 g/mol |
| LogP | 5.9545 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 593.74097 |
| Heavy Atoms | 29 |
| Complexity | 930.7258 |
Chemical Identifiers
| CAS Number | 98563-97-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2(C3(C4(C5(C2(C6(C3(C4(C(C56Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O |
Product Overview
2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL (CAS 98563-97-4), with molecular formula C17H8Cl10O2 and molecular weight 593.74 g/mol. IUPAC: 1,2,3,4,6,7,8,9,10,10-decachloro-5-phenylmethoxypentacyclo[5.3.0.02,6.03,9.04,8]decan-5-ol.
Chemical Property Profile of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL
Property Insights of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL
The XLogP value of 5.9545 indicates that 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.46 Ų, 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL?
The CAS number of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL is 98563-97-4.
What is the molecular formula of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL?
The molecular formula of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL is C17H8Cl10O2.
What is the molecular weight of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL?
The molecular weight of 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL is 593.74 g/mol.
Where can I buy 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL?
You can request a quote for 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzyloxy)-decachloro-octahydro-1,3,4-metheno-2H-cyclobuta(CD)pentalen-2-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.