1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate
TL;DR: 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate (CAS 413624-74-5) is a chemical compound with molecular formula C19H34O5 and molecular weight 342.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate
Also Known As: Dimethyl 2,2,12,12-tetramethyl-7-oxo-tridecanedioate, 1,13-DIMETHYL 2,2,12,12-TETRAMETHYL-7-OXOTRIDECANEDIOATE
| Molecular Formula | C19H34O5 |
|---|---|
| Molecular Weight | 342.24 g/mol |
| LogP | 4.0747 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 342.24063 |
| Heavy Atoms | 24 |
| Complexity | 385.47308 |
Chemical Identifiers
| CAS Number | 413624-74-5 |
|---|---|
| SMILES | CC(C)(CCCCC(=O)CCCCC(C)(C)C(=O)OC)C(=O)OC |
Product Overview
1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate (CAS 413624-74-5), with molecular formula C19H34O5 and molecular weight 342.24 g/mol. IUPAC: dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate.
Chemical Property Profile of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate
Property Insights of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate
The XLogP value of 4.0747 indicates that 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate. Following Lipinski's Rule of Five, 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate has 0 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 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate?
The CAS number of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate is 413624-74-5.
What is the molecular formula of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate?
The molecular formula of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate is C19H34O5.
What is the molecular weight of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate?
The molecular weight of 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate is 342.24 g/mol.
Where can I buy 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate?
You can request a quote for 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1,13-Dimethyl 2,2,12,12-tetramethyl-7-oxotridecanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.