Ephedrine,N,O-bis(heptafluorobutyryl) deriv.
TL;DR: Ephedrine,N,O-bis(heptafluorobutyryl) deriv. (CAS 66091-19-8) is a chemical compound with molecular formula C18H13F14NO3 and molecular weight 557.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2,2,3,3,4,4,4-heptafluorobutanoyl(methyl)amino]-1-phenylpropyl] 2,2,3,3,4,4,4-heptafluorobutanoate
Also Known As: Ephedrine, N,O-bis-HFB, N,O-Bis(heptafluorobutyryl)ephedrine, Ephedrine,N,O-bis(heptafluorobutyryl) deriv., 2a(NaMethylperfluorobutanamido)a1aphenylpropyl perfluorobutanoate, [2-[2,2,3,3,4,4,4-heptafluorobutanoyl(methyl)amino]-1-phenylpropyl] 2,2,3,3,4,4,4-heptafluorobutanoate
| Molecular Formula | C18H13F14NO3 |
|---|---|
| Molecular Weight | 557.07 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 9 |
| Exact Mass | 557.0672 |
| Heavy Atoms | 36 |
| Complexity | 802.0 |
Chemical Identifiers
| CAS Number | 66091-19-8 |
|---|---|
| SMILES | CC(C(C1=CC=CC=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)N(C)C(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | BCMWTPKOZMDVHA-UHFFFAOYSA-N |
Product Overview
Ephedrine,N,O-bis(heptafluorobutyryl) deriv. (CAS 66091-19-8), with molecular formula C18H13F14NO3 and molecular weight 557.07 g/mol. IUPAC: [2-[2,2,3,3,4,4,4-heptafluorobutanoyl(methyl)amino]-1-phenylpropyl] 2,2,3,3,4,4,4-heptafluorobutanoate.
Chemical Property Profile of Ephedrine,N,O-bis(heptafluorobutyryl) deriv.
Property Insights of Ephedrine,N,O-bis(heptafluorobutyryl) deriv.
The XLogP value of 6.5 indicates that Ephedrine,N,O-bis(heptafluorobutyryl) deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, Ephedrine,N,O-bis(heptafluorobutyryl) deriv. exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ephedrine,N,O-bis(heptafluorobutyryl) deriv. has 0 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ephedrine,N,O-bis(heptafluorobutyryl) deriv.?
The CAS number of Ephedrine,N,O-bis(heptafluorobutyryl) deriv. is 66091-19-8.
What is the molecular formula of Ephedrine,N,O-bis(heptafluorobutyryl) deriv.?
The molecular formula of Ephedrine,N,O-bis(heptafluorobutyryl) deriv. is C18H13F14NO3.
What is the molecular weight of Ephedrine,N,O-bis(heptafluorobutyryl) deriv.?
The molecular weight of Ephedrine,N,O-bis(heptafluorobutyryl) deriv. is 557.07 g/mol.
Where can I buy Ephedrine,N,O-bis(heptafluorobutyryl) deriv.?
You can request a quote for Ephedrine,N,O-bis(heptafluorobutyryl) deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ephedrine,N,O-bis(heptafluorobutyryl) deriv.?
Yes, KEHONG BIO provides custom synthesis services for Ephedrine,N,O-bis(heptafluorobutyryl) deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.