Clofop-isobutyl
TL;DR: Clofop-isobutyl (CAS 51337-71-4) is a chemical compound with molecular formula C19H21ClO4 and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-[4-(4-chlorophenoxy)phenoxy]propanoate
Also Known As: Clofop-isobutyl, Alopex, Clofop, Foxes, Clofop-isobutyl [ISO]
| Molecular Formula | C19H21ClO4 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 348.11282 |
| Heavy Atoms | 24 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 51337-71-4 |
|---|---|
| SMILES | CC(C)COC(=O)C(C)OC1=CC=C(C=C1)OC2=CC=C(C=C2)Cl |
| InChIKey | XNBRPBFBBCFVEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Clofop-isobutyl (CAS 51337-71-4), with molecular formula C19H21ClO4 and molecular weight 348.11 g/mol. IUPAC: 2-methylpropyl 2-[4-(4-chlorophenoxy)phenoxy]propanoate.
Chemical Property Profile of Clofop-isobutyl
Property Insights of Clofop-isobutyl
The XLogP value of 5.7 indicates that Clofop-isobutyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Clofop-isobutyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clofop-isobutyl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clofop-isobutyl?
The CAS number of Clofop-isobutyl is 51337-71-4.
What is the molecular formula of Clofop-isobutyl?
The molecular formula of Clofop-isobutyl is C19H21ClO4.
What is the molecular weight of Clofop-isobutyl?
The molecular weight of Clofop-isobutyl is 348.11 g/mol.
Where can I buy Clofop-isobutyl?
You can request a quote for Clofop-isobutyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clofop-isobutyl?
Yes, KEHONG BIO provides custom synthesis services for Clofop-isobutyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.