2-Chloro-1,1,1,3,4,4,4-heptafluorobutane
TL;DR: 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane (CAS 507453-83-0) is a chemical compound with molecular formula C4H2ClF7 and molecular weight 217.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1,1,1,3,4,4,4-heptafluorobutane
Also Known As: 2-chloro-1,1,1,3,4,4,4-heptafluorobutane, 2-chloro-1,1,1,3,4,4,4-heptafluoro-butane, Butane,2-chloro-1,1,1,3,4,4,4-heptafluoro-, Butane, 2-chloro-1,1,1,3,4,4,4-heptafluoro-, RefChem:258159
| Molecular Formula | C4H2ClF7 |
|---|---|
| Molecular Weight | 217.97 g/mol |
| LogP | 3.0565 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.97333 |
| Heavy Atoms | 12 |
| Complexity | 128.46582 |
Chemical Identifiers
| CAS Number | 507453-83-0 |
|---|---|
| SMILES | C(C(C(F)(F)F)Cl)(C(F)(F)F)F |
Product Overview
2-Chloro-1,1,1,3,4,4,4-heptafluorobutane (CAS 507453-83-0), with molecular formula C4H2ClF7 and molecular weight 217.97 g/mol. IUPAC: 2-chloro-1,1,1,3,4,4,4-heptafluorobutane.
Chemical Property Profile of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane
Property Insights of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane
The XLogP value of 3.0565 indicates that 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane?
The CAS number of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane is 507453-83-0.
What is the molecular formula of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane?
The molecular formula of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane is C4H2ClF7.
What is the molecular weight of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane?
The molecular weight of 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane is 217.97 g/mol.
Where can I buy 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane?
You can request a quote for 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1,1,1,3,4,4,4-heptafluorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.