4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
TL;DR: 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid (CAS 7079-86-9) is a chemical compound with molecular formula C7H6F7NO4 and molecular weight 301.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,5,5,6,6,6-heptafluoro-3-(nitromethyl)hexanoic acid
Also Known As: 4,4,5,5,6,6,6-heptafluoro-3-(nitromethyl)hexanoic acid, Hexanoicacid, 4,4,5,5,6,6,6-heptafluoro-3-(nitromethyl)-, RefChem:284743
| Molecular Formula | C7H6F7NO4 |
|---|---|
| Molecular Weight | 301.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.0185 |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 7079-86-9 |
|---|---|
| SMILES | C(C(C[N+](=O)[O-])C(C(C(F)(F)F)(F)F)(F)F)C(=O)O |
| InChIKey | MMHHDSOESNPFFR-UHFFFAOYSA-N |
Product Overview
4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid (CAS 7079-86-9), with molecular formula C7H6F7NO4 and molecular weight 301.02 g/mol. IUPAC: 4,4,5,5,6,6,6-heptafluoro-3-(nitromethyl)hexanoic acid.
Chemical Property Profile of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
Property Insights of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid. Following Lipinski's Rule of Five, 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid?
The CAS number of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid is 7079-86-9.
What is the molecular formula of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid?
The molecular formula of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid is C7H6F7NO4.
What is the molecular weight of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid?
The molecular weight of 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid is 301.02 g/mol.
Where can I buy 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid?
You can request a quote for 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,4,5,5,6,6,6-Heptafluoro-3-(nitromethyl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.