1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)
TL;DR: 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) (CAS 120219-50-3) is a chemical compound with molecular formula C12H8F14N2O2 and molecular weight 478.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,4-heptafluoro-1-[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]butan-1-one
Also Known As: N,N'-Bis(heptafluorobutyryl)piperazine, BAS 00075359, 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one), 1,4-Bis(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazine #, 1,1'-(piperazine-1,4-diyl)bis(2,2,3,3,4,4,4-heptafluorobutan-1-one)
| Molecular Formula | C12H8F14N2O2 |
|---|---|
| Molecular Weight | 478.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 4 |
| Exact Mass | 478.03622 |
| Heavy Atoms | 30 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 120219-50-3 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | POJOTJRIJQZXPG-UHFFFAOYSA-N |
Product Overview
1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) (CAS 120219-50-3), with molecular formula C12H8F14N2O2 and molecular weight 478.04 g/mol. IUPAC: 2,2,3,3,4,4,4-heptafluoro-1-[4-(2,2,3,3,4,4,4-heptafluorobutanoyl)piperazin-1-yl]butan-1-one.
Chemical Property Profile of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)
Property Insights of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)
The XLogP value of 3.9 indicates that 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) has 0 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 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)?
The CAS number of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) is 120219-50-3.
What is the molecular formula of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)?
The molecular formula of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) is C12H8F14N2O2.
What is the molecular weight of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)?
The molecular weight of 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) is 478.04 g/mol.
Where can I buy 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)?
You can request a quote for 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(Piperazine-1,4-diyl)bis(heptafluorobutan-1-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.