十二烷二酸1,12-二乙酯
TL;DR: 十二烷二酸1,12-二乙酯 (CAS 10471-28-0) is a chemical compound with molecular formula C16H30O4 and molecular weight 286.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十二烷二酸1,12-二乙酯
diethyl dodecanedioate
Also Known As: Diethyl dodecanedioate, Dodecanedioic Acid Diethyl Ester, Diethyl Dodecanoate, Diethyl dodecanedioate #, Docanedioic acid diethyl ester
| Molecular Formula | C16H30O4 |
|---|---|
| Molecular Weight | 286.21 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 286.21442 |
| Heavy Atoms | 20 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 10471-28-0 |
|---|---|
| SMILES | CCOC(=O)CCCCCCCCCCC(=O)OCC |
| InChIKey | AFYNPRWLOKYLDU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
十二烷二酸1,12-二乙酯 (CAS 10471-28-0), with molecular formula C16H30O4 and molecular weight 286.21 g/mol. IUPAC: diethyl dodecanedioate.
Chemical Property Profile of 十二烷二酸1,12-二乙酯
Property Insights of 十二烷二酸1,12-二乙酯
The XLogP value of 4.6 indicates that 十二烷二酸1,12-二乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 十二烷二酸1,12-二乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 十二烷二酸1,12-二乙酯 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 十二烷二酸1,12-二乙酯?
The CAS number of 十二烷二酸1,12-二乙酯 is 10471-28-0.
What is the molecular formula of 十二烷二酸1,12-二乙酯?
The molecular formula of 十二烷二酸1,12-二乙酯 is C16H30O4.
What is the molecular weight of 十二烷二酸1,12-二乙酯?
The molecular weight of 十二烷二酸1,12-二乙酯 is 286.21 g/mol.
Where can I buy 十二烷二酸1,12-二乙酯?
You can request a quote for 十二烷二酸1,12-二乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十二烷二酸1,12-二乙酯?
Yes, KEHONG BIO provides custom synthesis services for 十二烷二酸1,12-二乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.