Oxalic acid, butyl propyl ester
TL;DR: Oxalic acid, butyl propyl ester (CAS 26404-30-8) is a chemical compound with molecular formula C9H16O4 and molecular weight 188.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-butyl 1-O-propyl oxalate
Also Known As: Oxalic acid, butyl propyl ester, Oxalate, butyl propyl ester, oxalic acid butyl propyl ester, 2-O-butyl 1-O-propyl oxalate, RefChem:168798
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10 g/mol |
| LogP | 1.2829 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 164.99763 |
Chemical Identifiers
| CAS Number | 26404-30-8 |
|---|---|
| SMILES | CCCCOC(=O)C(=O)OCCC |
Product Overview
Oxalic acid, butyl propyl ester (CAS 26404-30-8), with molecular formula C9H16O4 and molecular weight 188.10 g/mol. IUPAC: 2-O-butyl 1-O-propyl oxalate.
Chemical Property Profile of Oxalic acid, butyl propyl ester
Property Insights of Oxalic acid, butyl propyl ester
The XLogP value of 1.2829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxalic acid, butyl propyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, Oxalic acid, butyl propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxalic acid, butyl propyl ester has 0 hydrogen bond donor(s) and 4 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 Oxalic acid, butyl propyl ester?
The CAS number of Oxalic acid, butyl propyl ester is 26404-30-8.
What is the molecular formula of Oxalic acid, butyl propyl ester?
The molecular formula of Oxalic acid, butyl propyl ester is C9H16O4.
What is the molecular weight of Oxalic acid, butyl propyl ester?
The molecular weight of Oxalic acid, butyl propyl ester is 188.10 g/mol.
Where can I buy Oxalic acid, butyl propyl ester?
You can request a quote for Oxalic acid, butyl propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalic acid, butyl propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Oxalic acid, butyl propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.