Tyramine, bis-N,O-(HFB)
TL;DR: Tyramine, bis-N,O-(HFB) (CAS 55521-08-9) is a chemical compound with molecular formula C16H9F14NO3 and molecular weight 529.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)ethyl]phenyl] 2,2,3,3,4,4,4-heptafluorobutanoate
Also Known As: Tyramine, bis-N,O-(HFB), 4-[2-[amino]ethyl]phenylheptafluorobutyrate, [4-[2-(Perfluorobutanoyl)aminoethyl]phenyl] perfluorobutanoate, Butanoic acid, heptafluoro-, 4-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]ethyl]phenyl ester, 4-[2-[(2,2,3,3,4,4,4-Heptafluoro-1-oxobutyl)amino]ethyl]phenylheptafluorobutyrate
| Molecular Formula | C16H9F14NO3 |
|---|---|
| Molecular Weight | 529.04 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 9 |
| Exact Mass | 529.0359 |
| Heavy Atoms | 34 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 55521-08-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CCNC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | IWESMRLDYXNPDI-UHFFFAOYSA-N |
Product Overview
Tyramine, bis-N,O-(HFB) (CAS 55521-08-9), with molecular formula C16H9F14NO3 and molecular weight 529.04 g/mol. IUPAC: [4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)ethyl]phenyl] 2,2,3,3,4,4,4-heptafluorobutanoate.
Chemical Property Profile of Tyramine, bis-N,O-(HFB)
Property Insights of Tyramine, bis-N,O-(HFB)
The XLogP value of 6.2 indicates that Tyramine, bis-N,O-(HFB) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Tyramine, bis-N,O-(HFB) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tyramine, bis-N,O-(HFB) has 1 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 Tyramine, bis-N,O-(HFB)?
The CAS number of Tyramine, bis-N,O-(HFB) is 55521-08-9.
What is the molecular formula of Tyramine, bis-N,O-(HFB)?
The molecular formula of Tyramine, bis-N,O-(HFB) is C16H9F14NO3.
What is the molecular weight of Tyramine, bis-N,O-(HFB)?
The molecular weight of Tyramine, bis-N,O-(HFB) is 529.04 g/mol.
Where can I buy Tyramine, bis-N,O-(HFB)?
You can request a quote for Tyramine, bis-N,O-(HFB) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tyramine, bis-N,O-(HFB)?
Yes, KEHONG BIO provides custom synthesis services for Tyramine, bis-N,O-(HFB) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.