N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate
TL;DR: N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate (CAS 145441-34-5) is a chemical compound with molecular formula C18H20F17NO2 and molecular weight 605.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]pentanoate
Also Known As: N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate, 1-Undecanaminium, N-(4-carboxybutyl)-N,N-dimethyl-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-, hydroxide, inner salt, 5-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)di(methyl)azaniumyl]pentanoate, 5-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)dimethylazaniumyl]pentanoate, 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]pentanoate
| Molecular Formula | C18H20F17NO2 |
|---|---|
| Molecular Weight | 605.12 g/mol |
| LogP | 5.7726 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 605.12225 |
| Heavy Atoms | 38 |
| Complexity | 820.2219 |
Chemical Identifiers
| CAS Number | 145441-34-5 |
|---|---|
| SMILES | C[N+](C)(CCCCC(=O)[O-])CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate (CAS 145441-34-5), with molecular formula C18H20F17NO2 and molecular weight 605.12 g/mol. IUPAC: 5-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl(dimethyl)azaniumyl]pentanoate.
Chemical Property Profile of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate
Property Insights of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate
The XLogP value of 5.7726 indicates that N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.13 Ų, N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate?
The CAS number of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate is 145441-34-5.
What is the molecular formula of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate?
The molecular formula of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate is C18H20F17NO2.
What is the molecular weight of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate?
The molecular weight of N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate is 605.12 g/mol.
Where can I buy N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate?
You can request a quote for N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-N-(3-F-octylpropyl)-5-ammoniopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.