3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)
TL;DR: 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) (CAS 1821-18-7) is a chemical compound with molecular formula C16H15Cl3F8N2O2 and molecular weight 524.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpiperazine;3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid
Also Known As: 3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid- 1-phenylpiperazine(1:1), 1-phenylpiperazine,3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluor, 1-Phenyl-piperazin,Salz der opt.-inakt.3,5,6-Trichlor-octafluor-hexansaeure, 1-phenylpiperazine,3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid, 1-phenylpiperazine; 3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid
| Molecular Formula | C16H15Cl3F8N2O2 |
|---|---|
| Molecular Weight | 524.01 g/mol |
| LogP | 5.0786 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 524.00714 |
| Heavy Atoms | 31 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 1821-18-7 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC=CC=C2.C(=O)(C(C(C(C(C(F)(F)Cl)(F)Cl)(F)F)(F)Cl)(F)F)O |
| InChIKey | ABJIZBPMCVGDBN-UHFFFAOYSA-N |
Product Overview
3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) (CAS 1821-18-7), with molecular formula C16H15Cl3F8N2O2 and molecular weight 524.01 g/mol. IUPAC: 1-phenylpiperazine;3,5,6-trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid.
Chemical Property Profile of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)
Property Insights of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)
The XLogP value of 5.0786 indicates that 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)?
The CAS number of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) is 1821-18-7.
What is the molecular formula of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)?
The molecular formula of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) is C16H15Cl3F8N2O2.
What is the molecular weight of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)?
The molecular weight of 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) is 524.01 g/mol.
Where can I buy 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)?
You can request a quote for 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 3,5,6-Trichloro-2,2,3,4,4,5,6,6-octafluorohexanoic acid-1-phenylpiperazine(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.