Methyl 2-methoxy-4-methylbenzoate
TL;DR: Methyl 2-methoxy-4-methylbenzoate (CAS 90527-52-9) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-methoxy-4-methylbenzoate
Also Known As: methyl 2-methoxy-4-methylbenzoate, methyl 2-methoxy-4-methyl-benzoate, methyl 2-methoxy-4-methybenzoate, 50-85-1-BDMS-Me, 2Me, Benzoic acid, methoxy-4-methyl-, methyl ester
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.79022 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 317.94595 |
Chemical Identifiers
| CAS Number | 90527-52-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)OC)OC |
Product Overview
Methyl 2-methoxy-4-methylbenzoate (CAS 90527-52-9), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: methyl 2-methoxy-4-methylbenzoate.
Chemical Property Profile of Methyl 2-methoxy-4-methylbenzoate
Property Insights of Methyl 2-methoxy-4-methylbenzoate
The XLogP value of 1.79022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-methoxy-4-methylbenzoate. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl 2-methoxy-4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-methoxy-4-methylbenzoate 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 Methyl 2-methoxy-4-methylbenzoate?
The CAS number of Methyl 2-methoxy-4-methylbenzoate is 90527-52-9.
What is the molecular formula of Methyl 2-methoxy-4-methylbenzoate?
The molecular formula of Methyl 2-methoxy-4-methylbenzoate is C10H12O3.
What is the molecular weight of Methyl 2-methoxy-4-methylbenzoate?
The molecular weight of Methyl 2-methoxy-4-methylbenzoate is 180.08 g/mol.
Where can I buy Methyl 2-methoxy-4-methylbenzoate?
You can request a quote for Methyl 2-methoxy-4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-methoxy-4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-methoxy-4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.