RefChem:869075
TL;DR: RefChem:869075 (CAS 69804-19-9) is a chemical compound with molecular formula C8F13NO2 and molecular weight 388.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3-tetrafluoro-3-[1,1,1,2,3,3-hexafluoro-3-(1,2,2-trifluoroethenoxy)propan-2-yl]oxypropanenitrile
Also Known As: C8F13NO2, 3-(1-(Difluoro((trifluorovinyl)oxy)methyl)tetrafluoroethoxy)tetrafluoropropionitrile, 2,2,3,3-Tetrafluoro-3-[[1,1,1,2,3,3-hexafluoro-3-[(1,2,2-trifluorovinyl)oxy]propan-2-yl]oxy]propionitrile, Propanenitrile,3-[1-[difluoro[(1,2,2-trifluoroethenyl)oxy]methyl]-1,2,2,2-tetrafluoroethoxy]-2,2,3,3-tetrafluoro-, Perfluoro-5-methyl-4,7-dioxanona-8-enenitrile
| Molecular Formula | C8F13NO2 |
|---|---|
| Molecular Weight | 388.97 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.97214 |
| Heavy Atoms | 24 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 69804-19-9 |
|---|---|
| SMILES | C(#N)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F |
| InChIKey | LYIPDZSLYLDLCU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:869075 (CAS 69804-19-9), with molecular formula C8F13NO2 and molecular weight 388.97 g/mol. IUPAC: 2,2,3,3-tetrafluoro-3-[1,1,1,2,3,3-hexafluoro-3-(1,2,2-trifluoroethenoxy)propan-2-yl]oxypropanenitrile.
Chemical Property Profile of RefChem:869075
Property Insights of RefChem:869075
The XLogP value of 4.5 indicates that RefChem:869075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.3 Ų, RefChem:869075 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:869075 has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:869075?
The CAS number of RefChem:869075 is 69804-19-9.
What is the molecular formula of RefChem:869075?
The molecular formula of RefChem:869075 is C8F13NO2.
What is the molecular weight of RefChem:869075?
The molecular weight of RefChem:869075 is 388.97 g/mol.
Where can I buy RefChem:869075?
You can request a quote for RefChem:869075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:869075?
Yes, KEHONG BIO provides custom synthesis services for RefChem:869075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.