Brn 5368036
TL;DR: Brn 5368036 (CAS 135587-16-5) is a chemical compound with molecular formula C16H16F16INO3Si and molecular weight 728.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluoro-1-iododecyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Also Known As: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluoro-1-iododecyl)-, 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Hexadecafluoro-1-iododecyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(1-Iodo-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorodecyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 5-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluoro-1-iododecyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane, BRN 5368036
| Molecular Formula | C16H16F16INO3Si |
|---|---|
| Molecular Weight | 728.97 g/mol |
| LogP | 5.7494 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 728.9689 |
| Heavy Atoms | 38 |
| Complexity | 820.993 |
Chemical Identifiers
| CAS Number | 135587-16-5 |
|---|---|
| SMILES | C1CO[Si]2(OCCN1CCO2)C(CC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I |
Product Overview
Brn 5368036 (CAS 135587-16-5), with molecular formula C16H16F16INO3Si and molecular weight 728.97 g/mol. IUPAC: 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluoro-1-iododecyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane.
Chemical Property Profile of Brn 5368036
Property Insights of Brn 5368036
The XLogP value of 5.7494 indicates that Brn 5368036 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.93 Ų, Brn 5368036 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Brn 5368036 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Brn 5368036?
The CAS number of Brn 5368036 is 135587-16-5.
What is the molecular formula of Brn 5368036?
The molecular formula of Brn 5368036 is C16H16F16INO3Si.
What is the molecular weight of Brn 5368036?
The molecular weight of Brn 5368036 is 728.97 g/mol.
Where can I buy Brn 5368036?
You can request a quote for Brn 5368036 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 5368036?
Yes, KEHONG BIO provides custom synthesis services for Brn 5368036 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.