2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate
TL;DR: 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate (CAS 85-71-2) is a chemical compound with molecular formula C13H16O6 and molecular weight 268.0947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate
Also Known As: Santicizer M-17, Methyl phthalyl ether glycolate, (Ethoxycarbonyl)methyl phthalate, Methyl carbethoxymethyl phthalate, BAG 956
Technical Specifications
| Molecular Formula | C13H16O6 |
| Molecular Weight | 268.0947 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 268.0947 Da |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
| SMILES | COC(=O)C1=CC=CC=C1C(=O)OCCC(CO)O |
| InChIKey | YJERZJLSXBRUDQ-UHFFFAOYSA-N |
Product Description
Applications: 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate (CAS 85-71-2) has the molecular formula C13H16O6 and a molecular weight of 268.09 g/mol. Synonyms include Santicizer M-17 and Methyl phthalyl ether glycolate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate
Property Insights of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate. Following Lipinski's Rule of Five, 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
The CAS number of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate is 85-71-2.
What is the molecular formula of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
The molecular formula of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate is C13H16O6.
What is the molecular weight of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
The molecular weight of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate is 268.0947 g/mol.
What are the applications of 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
You can request a quote for 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for 2-O-(3,4-dihydroxybutyl) 1-O-methyl benzene-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.