Di-tert-butyl glutarate
TL;DR: Di-tert-butyl glutarate (CAS 43052-39-7) is a chemical compound with molecular formula C13H24O4 and molecular weight 244.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl pentanedioate
Also Known As: Di-tert-butyl glutarate, ditert-butyl pentanedioate, di-tert-butylglutarate, Di-tert-butyl pentanedioate, EINECS 256-066-8
| Molecular Formula | C13H24O4 |
|---|---|
| Molecular Weight | 244.17 g/mol |
| LogP | 2.8401 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.16747 |
| Heavy Atoms | 17 |
| Complexity | 240.1245 |
Chemical Identifiers
| CAS Number | 43052-39-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)CCCC(=O)OC(C)(C)C |
Product Overview
Di-tert-butyl glutarate (CAS 43052-39-7), with molecular formula C13H24O4 and molecular weight 244.17 g/mol. IUPAC: ditert-butyl pentanedioate.
Chemical Property Profile of Di-tert-butyl glutarate
Property Insights of Di-tert-butyl glutarate
The XLogP value of 2.8401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Di-tert-butyl glutarate. With a topological polar surface area (TPSA) of 52.6 Ų, Di-tert-butyl glutarate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-tert-butyl glutarate 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 Di-tert-butyl glutarate?
The CAS number of Di-tert-butyl glutarate is 43052-39-7.
What is the molecular formula of Di-tert-butyl glutarate?
The molecular formula of Di-tert-butyl glutarate is C13H24O4.
What is the molecular weight of Di-tert-butyl glutarate?
The molecular weight of Di-tert-butyl glutarate is 244.17 g/mol.
Where can I buy Di-tert-butyl glutarate?
You can request a quote for Di-tert-butyl glutarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-tert-butyl glutarate?
Yes, KEHONG BIO provides custom synthesis services for Di-tert-butyl glutarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.