1-Chlorononafluorobutane
TL;DR: 1-Chlorononafluorobutane (CAS 558-89-4) is a chemical compound with molecular formula C4ClF9 and molecular weight 253.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane
Also Known As: 1-Chlorononafluorobutane, C4ClF9, 1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane, 1-CHLORONONFLUOROBUTANE, 4-chloro-1,1,1,2,2,3,3,4,4-nonafluorobutane
| Molecular Formula | C4ClF9 |
|---|---|
| Molecular Weight | 253.95 g/mol |
| LogP | 3.6509 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.95448 |
| Heavy Atoms | 14 |
| Complexity | 185.83229 |
Chemical Identifiers
| CAS Number | 558-89-4 |
|---|---|
| SMILES | C(C(C(F)(F)Cl)(F)F)(C(F)(F)F)(F)F |
Product Overview
1-Chlorononafluorobutane (CAS 558-89-4), with molecular formula C4ClF9 and molecular weight 253.95 g/mol. IUPAC: 1-chloro-1,1,2,2,3,3,4,4,4-nonafluorobutane.
Chemical Property Profile of 1-Chlorononafluorobutane
Property Insights of 1-Chlorononafluorobutane
The XLogP value of 3.6509 indicates that 1-Chlorononafluorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chlorononafluorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chlorononafluorobutane 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 1-Chlorononafluorobutane?
The CAS number of 1-Chlorononafluorobutane is 558-89-4.
What is the molecular formula of 1-Chlorononafluorobutane?
The molecular formula of 1-Chlorononafluorobutane is C4ClF9.
What is the molecular weight of 1-Chlorononafluorobutane?
The molecular weight of 1-Chlorononafluorobutane is 253.95 g/mol.
Where can I buy 1-Chlorononafluorobutane?
You can request a quote for 1-Chlorononafluorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chlorononafluorobutane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chlorononafluorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.