Butane-2,3-diyl bis(2-methylpentanoate)
TL;DR: Butane-2,3-diyl bis(2-methylpentanoate) (CAS 84006-18-8) 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.
3-(2-methylpentanoyloxy)butan-2-yl 2-methylpentanoate
Also Known As: 2,3-Butanediol bis(2-methylpentanoate), 1,2-Dimethyl-1,2-ethanediyl 2-methylpentanoate, Butane-2,3-diyl bis(2-methylpentanoate), J3.752.411E, Pentanoic acid, 2-methyl-, 1,2-dimethyl-1,2-ethanediyl ester
| Molecular Formula | C16H30O4 |
|---|---|
| Molecular Weight | 286.21 g/mol |
| LogP | 3.7222 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 286.21442 |
| Heavy Atoms | 20 |
| Complexity | 270.852 |
Chemical Identifiers
| CAS Number | 84006-18-8 |
|---|---|
| SMILES | CCCC(C)C(=O)OC(C)C(C)OC(=O)C(C)CCC |
Product Overview
Butane-2,3-diyl bis(2-methylpentanoate) (CAS 84006-18-8), with molecular formula C16H30O4 and molecular weight 286.21 g/mol. IUPAC: 3-(2-methylpentanoyloxy)butan-2-yl 2-methylpentanoate.
Chemical Property Profile of Butane-2,3-diyl bis(2-methylpentanoate)
Property Insights of Butane-2,3-diyl bis(2-methylpentanoate)
The XLogP value of 3.7222 indicates that Butane-2,3-diyl bis(2-methylpentanoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Butane-2,3-diyl bis(2-methylpentanoate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane-2,3-diyl bis(2-methylpentanoate) 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 Butane-2,3-diyl bis(2-methylpentanoate)?
The CAS number of Butane-2,3-diyl bis(2-methylpentanoate) is 84006-18-8.
What is the molecular formula of Butane-2,3-diyl bis(2-methylpentanoate)?
The molecular formula of Butane-2,3-diyl bis(2-methylpentanoate) is C16H30O4.
What is the molecular weight of Butane-2,3-diyl bis(2-methylpentanoate)?
The molecular weight of Butane-2,3-diyl bis(2-methylpentanoate) is 286.21 g/mol.
Where can I buy Butane-2,3-diyl bis(2-methylpentanoate)?
You can request a quote for Butane-2,3-diyl bis(2-methylpentanoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane-2,3-diyl bis(2-methylpentanoate)?
Yes, KEHONG BIO provides custom synthesis services for Butane-2,3-diyl bis(2-methylpentanoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.