RefChem:248912
TL;DR: RefChem:248912 (CAS 112330-85-5) is a chemical compound with molecular formula C11H15F7INO3Si and molecular weight 496.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,3,4,4,5,5,5-heptafluoro-1-iodopentyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: BAS 01184625, 1-(3,3,4,4,5,5,5-Heptafluoro-1-iodopentyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3,3,4,4,5,5,5-heptafluoro-1-iodopentyl)-, 1-(3,3,4,4,5,5,5-Heptafluoro-1-iodopentyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(1-Iodo-3,3,4,4,5,5,5-heptafluoropentyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
| Molecular Formula | C11H15F7INO3Si |
|---|---|
| Molecular Weight | 496.98 g/mol |
| LogP | 2.8701 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 496.9754 |
| Heavy Atoms | 24 |
| Complexity | 427.29413 |
Chemical Identifiers
| CAS Number | 112330-85-5 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CCO2)C(CC(C(C(F)(F)F)(F)F)(F)F)I |
Product Overview
RefChem:248912 (CAS 112330-85-5), with molecular formula C11H15F7INO3Si and molecular weight 496.98 g/mol. IUPAC: 1-(3,3,4,4,5,5,5-heptafluoro-1-iodopentyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane.
Chemical Property Profile of RefChem:248912
Property Insights of RefChem:248912
The XLogP value of 2.8701 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:248912. With a topological polar surface area (TPSA) of 30.93 Ų, RefChem:248912 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:248912 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:248912?
The CAS number of RefChem:248912 is 112330-85-5.
What is the molecular formula of RefChem:248912?
The molecular formula of RefChem:248912 is C11H15F7INO3Si.
What is the molecular weight of RefChem:248912?
The molecular weight of RefChem:248912 is 496.98 g/mol.
Where can I buy RefChem:248912?
You can request a quote for RefChem:248912 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:248912?
Yes, KEHONG BIO provides custom synthesis services for RefChem:248912 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.