1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate
TL;DR: 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate (CAS 13574-82-8) is a chemical compound with molecular formula C10H18O5 and molecular weight 218.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-butoxy-1-oxopropan-2-yl) 2-hydroxypropanoate
Also Known As: di-lactic acid butyl ester, NCIOpen2_004217, 1-butoxy-1-oxopropan-2-yl 2-hydroxypropanoate, butyl-2-lactoyloxy-propanoate, (1-butoxy-1-oxopropan-2-yl) 2-hydroxypropanoate
| Molecular Formula | C10H18O5 |
|---|---|
| Molecular Weight | 218.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.11542 |
| Heavy Atoms | 15 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 13574-82-8 |
|---|---|
| SMILES | CCCCOC(=O)C(C)OC(=O)C(C)O |
| InChIKey | QRCKUXOGGLKXGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate (CAS 13574-82-8), with molecular formula C10H18O5 and molecular weight 218.12 g/mol. IUPAC: (1-butoxy-1-oxopropan-2-yl) 2-hydroxypropanoate.
Chemical Property Profile of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate
Property Insights of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate. Following Lipinski's Rule of Five, 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate has 1 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 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate?
The CAS number of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate is 13574-82-8.
What is the molecular formula of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate?
The molecular formula of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate is C10H18O5.
What is the molecular weight of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate?
The molecular weight of 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate is 218.12 g/mol.
Where can I buy 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate?
You can request a quote for 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Butoxy-1-oxopropan-2-yl 2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.