Selenopentanoic acid, 4-methyl-, O-ethyl ester
TL;DR: Selenopentanoic acid, 4-methyl-, O-ethyl ester (CAS 62448-97-9) is a chemical compound with molecular formula C8H16OSe and molecular weight 208.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-ethyl 4-methylpentaneselenoate
Also Known As: o-Ethyl 4-methylpentaneselenoate, o-Ethyl 4-methylpentaneselenoate #, 1-ETHOXY-4-METHYLPENTANE-1-SELONE, 4-Methylpentaneselenoic acid O-ethyl ester, Selenopentanoic acid, 4-methyl-, O-ethyl ester
| Molecular Formula | C8H16OSe |
|---|---|
| Molecular Weight | 208.04 g/mol |
| LogP | 1.7575 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.03664 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 62448-97-9 |
|---|---|
| SMILES | CCOC(=[Se])CCC(C)C |
| InChIKey | ODHHHLPIVWEBRO-UHFFFAOYSA-N |
Product Overview
Selenopentanoic acid, 4-methyl-, O-ethyl ester (CAS 62448-97-9), with molecular formula C8H16OSe and molecular weight 208.04 g/mol. IUPAC: O-ethyl 4-methylpentaneselenoate.
Chemical Property Profile of Selenopentanoic acid, 4-methyl-, O-ethyl ester
Property Insights of Selenopentanoic acid, 4-methyl-, O-ethyl ester
The XLogP value of 1.7575 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Selenopentanoic acid, 4-methyl-, O-ethyl ester. With a topological polar surface area (TPSA) of 9.2 Ų, Selenopentanoic acid, 4-methyl-, O-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Selenopentanoic acid, 4-methyl-, O-ethyl ester has 0 hydrogen bond donor(s) and 1 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 Selenopentanoic acid, 4-methyl-, O-ethyl ester?
The CAS number of Selenopentanoic acid, 4-methyl-, O-ethyl ester is 62448-97-9.
What is the molecular formula of Selenopentanoic acid, 4-methyl-, O-ethyl ester?
The molecular formula of Selenopentanoic acid, 4-methyl-, O-ethyl ester is C8H16OSe.
What is the molecular weight of Selenopentanoic acid, 4-methyl-, O-ethyl ester?
The molecular weight of Selenopentanoic acid, 4-methyl-, O-ethyl ester is 208.04 g/mol.
Where can I buy Selenopentanoic acid, 4-methyl-, O-ethyl ester?
You can request a quote for Selenopentanoic acid, 4-methyl-, O-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Selenopentanoic acid, 4-methyl-, O-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Selenopentanoic acid, 4-methyl-, O-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.