1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one
TL;DR: 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one (CAS 781-97-5) is a chemical compound with molecular formula C9H4ClF5O and molecular weight 257.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one
Also Known As: 1-(4-chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one, pentafuoroethyl p-chlorophenyl ketone, 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoro-propan-1-one, Pentafluoroethyl 4-chlorophenyl ketone, 1-(4-chlorophenyl)-2,2,3,3,3-pentafluoropropane-1-one
| Molecular Formula | C9H4ClF5O |
|---|---|
| Molecular Weight | 257.99 g/mol |
| LogP | 3.7203 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.9871 |
| Heavy Atoms | 16 |
| Complexity | 395.35553 |
Chemical Identifiers
| CAS Number | 781-97-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C(C(F)(F)F)(F)F)Cl |
Product Overview
1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one (CAS 781-97-5), with molecular formula C9H4ClF5O and molecular weight 257.99 g/mol. IUPAC: 1-(4-chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one.
Chemical Property Profile of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one
Property Insights of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one
The XLogP value of 3.7203 indicates that 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one has 0 hydrogen bond donor(s) and 1 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-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one?
The CAS number of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one is 781-97-5.
What is the molecular formula of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one?
The molecular formula of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one is C9H4ClF5O.
What is the molecular weight of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one?
The molecular weight of 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one is 257.99 g/mol.
Where can I buy 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one?
You can request a quote for 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-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-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-2,2,3,3,3-pentafluoropropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.