3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-
TL;DR: 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- (CAS 1167-20-0) is a chemical compound with molecular formula C20H28F3NO and molecular weight 355.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[3-(trifluoromethyl)phenoxy]propyl]-3-azaspiro[5.5]undecane
Also Known As: H-KITPHOS, 3-AZASPIRO(5.5)UNDECANE, 3-(3-((alpha,alpha,alpha-TRIFLUORO-m-TOLYL)OXY)PROPYL)-, 3-(3-((alpha,alpha,alpha-Trifluoro-m-tolyl)oxy)propyl)3-azaspiro(5.5)undecane, 3-[3-[3-(trifluoromethyl)phenoxy]propyl]-3-azaspiro[5.5]undecane, 3-[3-[(alpha,alpha,alpha-Trifluoro-m-tolyl)oxy]propyl]-3-azaspiro[5.5]undecane
| Molecular Formula | C20H28F3NO |
|---|---|
| Molecular Weight | 355.21 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.2123 |
| Heavy Atoms | 25 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 1167-20-0 |
|---|---|
| SMILES | C1CCC2(CC1)CCN(CC2)CCCOC3=CC=CC(=C3)C(F)(F)F |
| InChIKey | DJBUNNYSMQHCMK-UHFFFAOYSA-N |
Product Overview
3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- (CAS 1167-20-0), with molecular formula C20H28F3NO and molecular weight 355.21 g/mol. IUPAC: 3-[3-[3-(trifluoromethyl)phenoxy]propyl]-3-azaspiro[5.5]undecane.
Chemical Property Profile of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-
Property Insights of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-
The XLogP value of 6.3 indicates that 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-?
The CAS number of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- is 1167-20-0.
What is the molecular formula of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-?
The molecular formula of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- is C20H28F3NO.
What is the molecular weight of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-?
The molecular weight of 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- is 355.21 g/mol.
Where can I buy 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-?
You can request a quote for 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Azaspiro(5.5)undecane, 3-(3-((alpha,alpha,alpha-trifluoro-m-tolyl)oxy)propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.