三氯乙酸酐
TL;DR: 三氯乙酸酐 (CAS 4124-31-6) is a chemical compound with molecular formula C4Cl6O3 and molecular weight 305.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三氯乙酸酐
(2,2,2-trichloroacetyl) 2,2,2-trichloroacetate
Also Known As: TRICHLOROACETIC ANHYDRIDE, trichloroaceticanhydride, trichloracetic anhydride, Acetic acid, trichloro-, anhydride, Perchloroacetic Anhydride
| Molecular Formula | C4Cl6O3 |
|---|---|
| Molecular Weight | 305.80 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.79492 |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 4124-31-6 |
|---|---|
| SMILES | C(=O)(C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl |
| InChIKey | MEFKFJOEVLUFAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三氯乙酸酐 (CAS 4124-31-6), with molecular formula C4Cl6O3 and molecular weight 305.80 g/mol. IUPAC: (2,2,2-trichloroacetyl) 2,2,2-trichloroacetate.
Chemical Property Profile of 三氯乙酸酐
Property Insights of 三氯乙酸酐
The XLogP value of 3.6 indicates that 三氯乙酸酐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 三氯乙酸酐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三氯乙酸酐 has 0 hydrogen bond donor(s) and 3 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 三氯乙酸酐?
The CAS number of 三氯乙酸酐 is 4124-31-6.
What is the molecular formula of 三氯乙酸酐?
The molecular formula of 三氯乙酸酐 is C4Cl6O3.
What is the molecular weight of 三氯乙酸酐?
The molecular weight of 三氯乙酸酐 is 305.80 g/mol.
Where can I buy 三氯乙酸酐?
You can request a quote for 三氯乙酸酐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三氯乙酸酐?
Yes, KEHONG BIO provides custom synthesis services for 三氯乙酸酐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.