Bis(2-methylbutyl) pentanedioate
TL;DR: Bis(2-methylbutyl) pentanedioate (CAS 7424-66-0) is a chemical compound with molecular formula C15H28O4 and molecular weight 272.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methylbutyl) pentanedioate
Also Known As: bis(2-methylbutyl) pentanedioate, Glutaric acid, di(2-methylbutyl) ester, Pentanedioicacid, 1,5-bis(2-methylbutyl) ester, Pentanedioicacid,1,5-bis(2-methylbutyl)ester, Pentanedioicacid,1,5-bis(2-methylbutyl) ester
| Molecular Formula | C15H28O4 |
|---|---|
| Molecular Weight | 272.20 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 272.19876 |
| Heavy Atoms | 19 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 7424-66-0 |
|---|---|
| SMILES | CCC(C)COC(=O)CCCC(=O)OCC(C)CC |
| InChIKey | KCMGCXMWIATDCV-UHFFFAOYSA-N |
Product Overview
Bis(2-methylbutyl) pentanedioate (CAS 7424-66-0), with molecular formula C15H28O4 and molecular weight 272.20 g/mol. IUPAC: bis(2-methylbutyl) pentanedioate.
Chemical Property Profile of Bis(2-methylbutyl) pentanedioate
Property Insights of Bis(2-methylbutyl) pentanedioate
The XLogP value of 3.6 indicates that Bis(2-methylbutyl) pentanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Bis(2-methylbutyl) pentanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-methylbutyl) pentanedioate 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 Bis(2-methylbutyl) pentanedioate?
The CAS number of Bis(2-methylbutyl) pentanedioate is 7424-66-0.
What is the molecular formula of Bis(2-methylbutyl) pentanedioate?
The molecular formula of Bis(2-methylbutyl) pentanedioate is C15H28O4.
What is the molecular weight of Bis(2-methylbutyl) pentanedioate?
The molecular weight of Bis(2-methylbutyl) pentanedioate is 272.20 g/mol.
Where can I buy Bis(2-methylbutyl) pentanedioate?
You can request a quote for Bis(2-methylbutyl) pentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-methylbutyl) pentanedioate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-methylbutyl) pentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.