1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
TL;DR: 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane (CAS 112330-84-4) is a chemical compound with molecular formula C9H15F3INO3Si and molecular weight 396.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,3,3-trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: 1-(3,3,3-Trifluoro-1-iodopropyl)-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-(3,3,3-trifluoro-1-iodopropyl)-, 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(1-Iodo-3,3,3-trifluoropropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 5-(3,3,3-trifluoro-1-iodopropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
| Molecular Formula | C9H15F3INO3Si |
|---|---|
| Molecular Weight | 396.98 g/mol |
| LogP | 1.5995 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.9818 |
| Heavy Atoms | 18 |
| Complexity | 268.19232 |
Chemical Identifiers
| CAS Number | 112330-84-4 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CCO2)C(CC(F)(F)F)I |
Product Overview
1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane (CAS 112330-84-4), with molecular formula C9H15F3INO3Si and molecular weight 396.98 g/mol. IUPAC: 1-(3,3,3-trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane.
Chemical Property Profile of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
Property Insights of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
The XLogP value of 1.5995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane. With a topological polar surface area (TPSA) of 30.93 Ų, 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane 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 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane?
The CAS number of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane is 112330-84-4.
What is the molecular formula of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane?
The molecular formula of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane is C9H15F3INO3Si.
What is the molecular weight of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane?
The molecular weight of 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane is 396.98 g/mol.
Where can I buy 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane?
You can request a quote for 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,3,3-Trifluoro-1-iodopropyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.