4-Methylpentyl pentanoate
TL;DR: 4-Methylpentyl pentanoate (CAS 35852-47-2) is a chemical compound with molecular formula C11H22O2 and molecular weight 186.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylpentyl pentanoate
Also Known As: 4-Methylpentyl pentanoate, 4-Methylpentyl pentanoate #, RefChem:294632
| Molecular Formula | C11H22O2 |
|---|---|
| Molecular Weight | 186.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 186.16199 |
| Heavy Atoms | 13 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 35852-47-2 |
|---|---|
| SMILES | CCCCC(=O)OCCCC(C)C |
| InChIKey | DGPWYHDBEBYWGH-UHFFFAOYSA-N |
Product Overview
4-Methylpentyl pentanoate (CAS 35852-47-2), with molecular formula C11H22O2 and molecular weight 186.16 g/mol. IUPAC: 4-methylpentyl pentanoate.
Chemical Property Profile of 4-Methylpentyl pentanoate
Property Insights of 4-Methylpentyl pentanoate
The XLogP value of 3.5 indicates that 4-Methylpentyl pentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Methylpentyl pentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylpentyl pentanoate has 0 hydrogen bond donor(s) and 2 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 4-Methylpentyl pentanoate?
The CAS number of 4-Methylpentyl pentanoate is 35852-47-2.
What is the molecular formula of 4-Methylpentyl pentanoate?
The molecular formula of 4-Methylpentyl pentanoate is C11H22O2.
What is the molecular weight of 4-Methylpentyl pentanoate?
The molecular weight of 4-Methylpentyl pentanoate is 186.16 g/mol.
Where can I buy 4-Methylpentyl pentanoate?
You can request a quote for 4-Methylpentyl pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylpentyl pentanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylpentyl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.