Propionic acid, 3-(allylthio)-, isobutyl ester
TL;DR: Propionic acid, 3-(allylthio)-, isobutyl ester (CAS 24382-60-3) is a chemical compound with molecular formula C10H18O2S and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 3-prop-2-enylsulfanylpropanoate
Also Known As: isobutyl 3-(allylthio)propanoate, Isobutyl 3-(allylsulfanyl)propanoate, Isobutyl 3-(allylsulfanyl)propanoate #, 3-(Allylthio)propionic acid isobutyl ester, Propionic acid, 3-(allylthio)-, isobutyl ester
| Molecular Formula | C10H18O2S |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.10275 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 24382-60-3 |
|---|---|
| SMILES | CC(C)COC(=O)CCSCC=C |
| InChIKey | QSSWDRZOZNJUHU-UHFFFAOYSA-N |
Product Overview
Propionic acid, 3-(allylthio)-, isobutyl ester (CAS 24382-60-3), with molecular formula C10H18O2S and molecular weight 202.10 g/mol. IUPAC: 2-methylpropyl 3-prop-2-enylsulfanylpropanoate.
Chemical Property Profile of Propionic acid, 3-(allylthio)-, isobutyl ester
Property Insights of Propionic acid, 3-(allylthio)-, isobutyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propionic acid, 3-(allylthio)-, isobutyl ester. With a topological polar surface area (TPSA) of 51.6 Ų, Propionic acid, 3-(allylthio)-, isobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid, 3-(allylthio)-, isobutyl ester 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 Propionic acid, 3-(allylthio)-, isobutyl ester?
The CAS number of Propionic acid, 3-(allylthio)-, isobutyl ester is 24382-60-3.
What is the molecular formula of Propionic acid, 3-(allylthio)-, isobutyl ester?
The molecular formula of Propionic acid, 3-(allylthio)-, isobutyl ester is C10H18O2S.
What is the molecular weight of Propionic acid, 3-(allylthio)-, isobutyl ester?
The molecular weight of Propionic acid, 3-(allylthio)-, isobutyl ester is 202.10 g/mol.
Where can I buy Propionic acid, 3-(allylthio)-, isobutyl ester?
You can request a quote for Propionic acid, 3-(allylthio)-, isobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propionic acid, 3-(allylthio)-, isobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, 3-(allylthio)-, isobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.