Methyl 4-methoxycarbonyloxybenzoate
TL;DR: Methyl 4-methoxycarbonyloxybenzoate (CAS 17175-20-1) is a chemical compound with molecular formula C10H10O5 and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-methoxycarbonyloxybenzoate
Also Known As: methyl 4-methoxycarbonyloxybenzoate, Methyl 4-[(methoxycarbonyl)oxy]benzoate, methyl 4-((methoxycarbonyl)oxy)benzoate, Methyl 4-(carboxyoxy)-3-methylbenzoate, Methyl 4-[(methoxycarbonyl)oxy]benzoate #
| Molecular Formula | C10H10O5 |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.05283 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 17175-20-1 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)OC(=O)OC |
| InChIKey | XDDBMNQUNQHNNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-methoxycarbonyloxybenzoate (CAS 17175-20-1), with molecular formula C10H10O5 and molecular weight 210.05 g/mol. IUPAC: methyl 4-methoxycarbonyloxybenzoate.
Chemical Property Profile of Methyl 4-methoxycarbonyloxybenzoate
Property Insights of Methyl 4-methoxycarbonyloxybenzoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-methoxycarbonyloxybenzoate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-methoxycarbonyloxybenzoate. Following Lipinski's Rule of Five, Methyl 4-methoxycarbonyloxybenzoate has 0 hydrogen bond donor(s) and 5 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 4-methoxycarbonyloxybenzoate?
The CAS number of Methyl 4-methoxycarbonyloxybenzoate is 17175-20-1.
What is the molecular formula of Methyl 4-methoxycarbonyloxybenzoate?
The molecular formula of Methyl 4-methoxycarbonyloxybenzoate is C10H10O5.
What is the molecular weight of Methyl 4-methoxycarbonyloxybenzoate?
The molecular weight of Methyl 4-methoxycarbonyloxybenzoate is 210.05 g/mol.
Where can I buy Methyl 4-methoxycarbonyloxybenzoate?
You can request a quote for Methyl 4-methoxycarbonyloxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-methoxycarbonyloxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-methoxycarbonyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.