Methyl 3-methoxycarbonyloxybenzoate
TL;DR: Methyl 3-methoxycarbonyloxybenzoate (CAS 17161-32-9) 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 3-methoxycarbonyloxybenzoate
Also Known As: methyl 3-methoxycarbonyloxybenzoate, Methyl 3-[(methoxycarbonyl)oxy]benzoate, methyl 3-((methoxycarbonyl)oxy)benzoate, Methyl 3-(carboxyoxy)-2-methylbenzoate, Methyl 3-[(methoxycarbonyl)oxy]benzoate #
| Molecular Formula | C10H10O5 |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 2.0 |
| 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 | 238.0 |
Chemical Identifiers
| CAS Number | 17161-32-9 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC=C1)OC(=O)OC |
| InChIKey | GWXXUUWQSFJIDZ-UHFFFAOYSA-N |
Product Overview
Methyl 3-methoxycarbonyloxybenzoate (CAS 17161-32-9), with molecular formula C10H10O5 and molecular weight 210.05 g/mol. IUPAC: methyl 3-methoxycarbonyloxybenzoate.
Chemical Property Profile of Methyl 3-methoxycarbonyloxybenzoate
Property Insights of Methyl 3-methoxycarbonyloxybenzoate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methoxycarbonyloxybenzoate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methoxycarbonyloxybenzoate. Following Lipinski's Rule of Five, Methyl 3-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 3-methoxycarbonyloxybenzoate?
The CAS number of Methyl 3-methoxycarbonyloxybenzoate is 17161-32-9.
What is the molecular formula of Methyl 3-methoxycarbonyloxybenzoate?
The molecular formula of Methyl 3-methoxycarbonyloxybenzoate is C10H10O5.
What is the molecular weight of Methyl 3-methoxycarbonyloxybenzoate?
The molecular weight of Methyl 3-methoxycarbonyloxybenzoate is 210.05 g/mol.
Where can I buy Methyl 3-methoxycarbonyloxybenzoate?
You can request a quote for Methyl 3-methoxycarbonyloxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methoxycarbonyloxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methoxycarbonyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.