p-Methylphenoxyacetic acid
TL;DR: p-Methylphenoxyacetic acid (CAS 940-64-7) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenoxy)acetic acid
Also Known As: (4-Methylphenoxy)acetic acid, 2-(4-methylphenoxy)acetic acid, 4-Methylphenoxyacetic acid, p-Methylphenoxyacetic acid, aceticacid
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 940-64-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC(=O)O |
| InChIKey | SFTDDFBJWUWKMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Methylphenoxyacetic acid (CAS 940-64-7), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 2-(4-methylphenoxy)acetic acid.
Chemical Property Profile of p-Methylphenoxyacetic acid
Property Insights of p-Methylphenoxyacetic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Methylphenoxyacetic acid. With a topological polar surface area (TPSA) of 46.5 Ų, p-Methylphenoxyacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Methylphenoxyacetic acid has 1 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 p-Methylphenoxyacetic acid?
The CAS number of p-Methylphenoxyacetic acid is 940-64-7.
What is the molecular formula of p-Methylphenoxyacetic acid?
The molecular formula of p-Methylphenoxyacetic acid is C9H10O3.
What is the molecular weight of p-Methylphenoxyacetic acid?
The molecular weight of p-Methylphenoxyacetic acid is 166.06 g/mol.
Where can I buy p-Methylphenoxyacetic acid?
You can request a quote for p-Methylphenoxyacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Methylphenoxyacetic acid?
Yes, KEHONG BIO provides custom synthesis services for p-Methylphenoxyacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.