酒石酸二丁酯
TL;DR: 酒石酸二丁酯 (CAS 87-92-3) is a chemical compound with molecular formula C12H22O6 and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酒石酸二丁酯
dibutyl (2R,3R)-2,3-dihydroxybutanedioate
Also Known As: Dibutyl L-tartrate, DIBUTYL TARTRATE, Dibutyl L-(+)-Tartrate, (2R,3R)-Dibutyl 2,3-dihydroxysuccinate, (+)-dibutyl tartrate
| Molecular Formula | C12H22O6 |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 262.14163 |
| Heavy Atoms | 18 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 87-92-3 |
|---|---|
| SMILES | CCCCOC(=O)[C@@H]([C@H](C(=O)OCCCC)O)O |
| InChIKey | PCYQQSKDZQTOQG-NXEZZACHSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
酒石酸二丁酯 (CAS 87-92-3), with molecular formula C12H22O6 and molecular weight 262.14 g/mol. IUPAC: dibutyl (2R,3R)-2,3-dihydroxybutanedioate.
Chemical Property Profile of 酒石酸二丁酯
Property Insights of 酒石酸二丁酯
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 酒石酸二丁酯. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 酒石酸二丁酯. Following Lipinski's Rule of Five, 酒石酸二丁酯 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
Frequently Asked Questions
What is the CAS number of 酒石酸二丁酯?
The CAS number of 酒石酸二丁酯 is 87-92-3.
What is the molecular formula of 酒石酸二丁酯?
The molecular formula of 酒石酸二丁酯 is C12H22O6.
What is the molecular weight of 酒石酸二丁酯?
The molecular weight of 酒石酸二丁酯 is 262.14 g/mol.
Where can I buy 酒石酸二丁酯?
You can request a quote for 酒石酸二丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酒石酸二丁酯?
Yes, KEHONG BIO provides custom synthesis services for 酒石酸二丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.