Decanedioic acid, 3,7-dimethyl-, dimethyl ester
TL;DR: Decanedioic acid, 3,7-dimethyl-, dimethyl ester (CAS 5131-46-4) is a chemical compound with molecular formula C14H26O4 and molecular weight 258.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3,7-dimethyldecanedioate
Also Known As: Dimethyl 3,7-dimethyldecanedioate, 3,7-Dimethyldecanedioicaciddimethylester, Dimethyl 3,7-dimethyldecanedioate #, 1,10-dimethyl 3,7-dimethyldecanedioate, 3,7-Dimethyldecanedioic acid dimethyl ester
| Molecular Formula | C14H26O4 |
|---|---|
| Molecular Weight | 258.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 258.1831 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 5131-46-4 |
|---|---|
| SMILES | CC(CCCC(C)CC(=O)OC)CCC(=O)OC |
| InChIKey | KYCNZHVRCVHSAH-UHFFFAOYSA-N |
Product Overview
Decanedioic acid, 3,7-dimethyl-, dimethyl ester (CAS 5131-46-4), with molecular formula C14H26O4 and molecular weight 258.18 g/mol. IUPAC: dimethyl 3,7-dimethyldecanedioate.
Chemical Property Profile of Decanedioic acid, 3,7-dimethyl-, dimethyl ester
Property Insights of Decanedioic acid, 3,7-dimethyl-, dimethyl ester
The XLogP value of 3.4 indicates that Decanedioic acid, 3,7-dimethyl-, dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Decanedioic acid, 3,7-dimethyl-, dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decanedioic acid, 3,7-dimethyl-, dimethyl 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 Decanedioic acid, 3,7-dimethyl-, dimethyl ester?
The CAS number of Decanedioic acid, 3,7-dimethyl-, dimethyl ester is 5131-46-4.
What is the molecular formula of Decanedioic acid, 3,7-dimethyl-, dimethyl ester?
The molecular formula of Decanedioic acid, 3,7-dimethyl-, dimethyl ester is C14H26O4.
What is the molecular weight of Decanedioic acid, 3,7-dimethyl-, dimethyl ester?
The molecular weight of Decanedioic acid, 3,7-dimethyl-, dimethyl ester is 258.18 g/mol.
Where can I buy Decanedioic acid, 3,7-dimethyl-, dimethyl ester?
You can request a quote for Decanedioic acid, 3,7-dimethyl-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanedioic acid, 3,7-dimethyl-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Decanedioic acid, 3,7-dimethyl-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.