Methyl 5-methylsulfonyloxypent-2-enoate
TL;DR: Methyl 5-methylsulfonyloxypent-2-enoate (CAS 62592-76-1) is a chemical compound with molecular formula C7H12O5S and molecular weight 208.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-methylsulfonyloxypent-2-enoate
Also Known As: methyl 5-methylsulfonyloxypent-2-enoate, Methyl 5-[(methanesulfonyl)oxy]pent-2-enoate
| Molecular Formula | C7H12O5S |
|---|---|
| Molecular Weight | 208.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.04054 |
| Heavy Atoms | 13 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 62592-76-1 |
|---|---|
| SMILES | COC(=O)C=CCCOS(=O)(=O)C |
| InChIKey | LTJTYWPDRQOIEI-UHFFFAOYSA-N |
Product Overview
Methyl 5-methylsulfonyloxypent-2-enoate (CAS 62592-76-1), with molecular formula C7H12O5S and molecular weight 208.04 g/mol. IUPAC: methyl 5-methylsulfonyloxypent-2-enoate.
Chemical Property Profile of Methyl 5-methylsulfonyloxypent-2-enoate
Property Insights of Methyl 5-methylsulfonyloxypent-2-enoate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-methylsulfonyloxypent-2-enoate. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-methylsulfonyloxypent-2-enoate. Following Lipinski's Rule of Five, Methyl 5-methylsulfonyloxypent-2-enoate has 0 hydrogen bond donor(s) and 5 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 Methyl 5-methylsulfonyloxypent-2-enoate?
The CAS number of Methyl 5-methylsulfonyloxypent-2-enoate is 62592-76-1.
What is the molecular formula of Methyl 5-methylsulfonyloxypent-2-enoate?
The molecular formula of Methyl 5-methylsulfonyloxypent-2-enoate is C7H12O5S.
What is the molecular weight of Methyl 5-methylsulfonyloxypent-2-enoate?
The molecular weight of Methyl 5-methylsulfonyloxypent-2-enoate is 208.04 g/mol.
Where can I buy Methyl 5-methylsulfonyloxypent-2-enoate?
You can request a quote for Methyl 5-methylsulfonyloxypent-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-methylsulfonyloxypent-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-methylsulfonyloxypent-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.