RefChem:146171
TL;DR: RefChem:146171 (CAS 68015-84-9) is a chemical compound with molecular formula C9H8F13NO2 and molecular weight 409.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,5,6,6,6-decafluoro-5-(trifluoromethyl)hexanoic acid;ethanamine
Also Known As: C7HF13O2.C2H7N, Hexanoic acid, 2,2,3,3,4,4,5,6,6,6-decafluoro-5-(trifluoromethyl)-, compd. with ethanamine (1:1), 2,2,3,3,4,4,5,6,6,6-decafluoro-5-(trifluoromethyl)hexanoic acid- ethanamine(1:1), 2,2,3,3,4,4,5,6,6,6-Decafluoro-5-(trifluoromethyl)hexanoic acid, compound with ethylamine (1:1), 2,2,3,3,4,4,5,6,6,6-decafluoro-5-(trifluoromethyl)hexanoic acid; ethanamine
| Molecular Formula | C9H8F13NO2 |
|---|---|
| Molecular Weight | 409.03 g/mol |
| LogP | 3.77 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.03476 |
| Heavy Atoms | 25 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 68015-84-9 |
|---|---|
| SMILES | CCN.C(=O)(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)O |
| InChIKey | YSXXTTJIKUEKFH-UHFFFAOYSA-N |
Product Overview
RefChem:146171 (CAS 68015-84-9), with molecular formula C9H8F13NO2 and molecular weight 409.03 g/mol. IUPAC: 2,2,3,3,4,4,5,6,6,6-decafluoro-5-(trifluoromethyl)hexanoic acid;ethanamine.
Chemical Property Profile of RefChem:146171
Property Insights of RefChem:146171
The XLogP value of 3.77 indicates that RefChem:146171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:146171. Following Lipinski's Rule of Five, RefChem:146171 has 2 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:146171?
The CAS number of RefChem:146171 is 68015-84-9.
What is the molecular formula of RefChem:146171?
The molecular formula of RefChem:146171 is C9H8F13NO2.
What is the molecular weight of RefChem:146171?
The molecular weight of RefChem:146171 is 409.03 g/mol.
Where can I buy RefChem:146171?
You can request a quote for RefChem:146171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:146171?
Yes, KEHONG BIO provides custom synthesis services for RefChem:146171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.