1-Methoxypropan-2-yl pentanoate
TL;DR: 1-Methoxypropan-2-yl pentanoate (CAS 6311-97-3) is a chemical compound with molecular formula C9H18O3 and molecular weight 174.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxypropan-2-yl pentanoate
Also Known As: 1-methoxypropan-2-yl pentanoate, 1-Methyl-2-methoxyethyl pentanoate, Pentanoic acid,2-methoxy-1-methylethyl ester, RefChem:231392
| Molecular Formula | C9H18O3 |
|---|---|
| Molecular Weight | 174.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 174.1256 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 6311-97-3 |
|---|---|
| SMILES | CCCCC(=O)OC(C)COC |
| InChIKey | IOQOAKZXOSLXED-UHFFFAOYSA-N |
Product Overview
1-Methoxypropan-2-yl pentanoate (CAS 6311-97-3), with molecular formula C9H18O3 and molecular weight 174.13 g/mol. IUPAC: 1-methoxypropan-2-yl pentanoate.
Chemical Property Profile of 1-Methoxypropan-2-yl pentanoate
Property Insights of 1-Methoxypropan-2-yl pentanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxypropan-2-yl pentanoate. With a topological polar surface area (TPSA) of 35.5 Ų, 1-Methoxypropan-2-yl pentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxypropan-2-yl pentanoate has 0 hydrogen bond donor(s) and 3 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-Methoxypropan-2-yl pentanoate?
The CAS number of 1-Methoxypropan-2-yl pentanoate is 6311-97-3.
What is the molecular formula of 1-Methoxypropan-2-yl pentanoate?
The molecular formula of 1-Methoxypropan-2-yl pentanoate is C9H18O3.
What is the molecular weight of 1-Methoxypropan-2-yl pentanoate?
The molecular weight of 1-Methoxypropan-2-yl pentanoate is 174.13 g/mol.
Where can I buy 1-Methoxypropan-2-yl pentanoate?
You can request a quote for 1-Methoxypropan-2-yl pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxypropan-2-yl pentanoate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxypropan-2-yl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.