3,5-Bis(trifluoromethyl)phenylacetyl chloride
TL;DR: 3,5-Bis(trifluoromethyl)phenylacetyl chloride (CAS 174083-39-7) is a chemical compound with molecular formula C10H5ClF6O and molecular weight 289.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,5-bis(trifluoromethyl)phenyl]acetyl chloride
Also Known As: 3,5-Bis(trifluoromethyl)phenylacetyl chloride, 2-[3,5-bis(trifluoromethyl)phenyl]acetyl Chloride, (R)-3-Aminopentanenitrile, 3,5-Bis(trifluoromethyl)phenylacetylchloride, 2-(3,5-Bis(trifluoromethyl)phenyl)acetyl chloride
| Molecular Formula | C10H5ClF6O |
|---|---|
| Molecular Weight | 289.99 g/mol |
| LogP | 4.0321 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.99332 |
| Heavy Atoms | 18 |
| Complexity | 430.1662 |
Chemical Identifiers
| CAS Number | 174083-39-7 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)Cl |
Product Overview
3,5-Bis(trifluoromethyl)phenylacetyl chloride (CAS 174083-39-7), with molecular formula C10H5ClF6O and molecular weight 289.99 g/mol. IUPAC: 2-[3,5-bis(trifluoromethyl)phenyl]acetyl chloride.
Chemical Property Profile of 3,5-Bis(trifluoromethyl)phenylacetyl chloride
Property Insights of 3,5-Bis(trifluoromethyl)phenylacetyl chloride
The XLogP value of 4.0321 indicates that 3,5-Bis(trifluoromethyl)phenylacetyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3,5-Bis(trifluoromethyl)phenylacetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(trifluoromethyl)phenylacetyl chloride 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 3,5-Bis(trifluoromethyl)phenylacetyl chloride?
The CAS number of 3,5-Bis(trifluoromethyl)phenylacetyl chloride is 174083-39-7.
What is the molecular formula of 3,5-Bis(trifluoromethyl)phenylacetyl chloride?
The molecular formula of 3,5-Bis(trifluoromethyl)phenylacetyl chloride is C10H5ClF6O.
What is the molecular weight of 3,5-Bis(trifluoromethyl)phenylacetyl chloride?
The molecular weight of 3,5-Bis(trifluoromethyl)phenylacetyl chloride is 289.99 g/mol.
Where can I buy 3,5-Bis(trifluoromethyl)phenylacetyl chloride?
You can request a quote for 3,5-Bis(trifluoromethyl)phenylacetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(trifluoromethyl)phenylacetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(trifluoromethyl)phenylacetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.