MCPA甲酯
TL;DR: MCPA甲酯 (CAS 2436-73-9) is a chemical compound with molecular formula C10H11ClO3 and molecular weight 214.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
MCPA甲酯
methyl 2-(4-chloro-2-methylphenoxy)acetate
Also Known As: MCPA methyl ester, MCPA-methyl, methyl 2-(4-chloro-2-methylphenoxy)acetate, Methyl 4-chloro-2-methylphenoxyacetate, MCPA-methyl [ISO]
| Molecular Formula | C10H11ClO3 |
|---|---|
| Molecular Weight | 214.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.03967 |
| Heavy Atoms | 14 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 2436-73-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)OC |
| InChIKey | VWERIRLJUWTNDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
MCPA甲酯 (CAS 2436-73-9), with molecular formula C10H11ClO3 and molecular weight 214.04 g/mol. IUPAC: methyl 2-(4-chloro-2-methylphenoxy)acetate.
Chemical Property Profile of MCPA甲酯
Property Insights of MCPA甲酯
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for MCPA甲酯. With a topological polar surface area (TPSA) of 35.5 Ų, MCPA甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, MCPA甲酯 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 MCPA甲酯?
The CAS number of MCPA甲酯 is 2436-73-9.
What is the molecular formula of MCPA甲酯?
The molecular formula of MCPA甲酯 is C10H11ClO3.
What is the molecular weight of MCPA甲酯?
The molecular weight of MCPA甲酯 is 214.04 g/mol.
Where can I buy MCPA甲酯?
You can request a quote for MCPA甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MCPA甲酯?
Yes, KEHONG BIO provides custom synthesis services for MCPA甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.