Ethyl 3-(methylthio)-2-propenoate, (2Z)-
TL;DR: Ethyl 3-(methylthio)-2-propenoate, (2Z)- (CAS 136115-66-7) is a chemical compound with molecular formula C6H10O2S and molecular weight 146.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-3-methylsulfanylprop-2-enoate
Also Known As: FEMA No. 4563, Ethyl 3-(methylthio)-(Z)-2-propenoate, Ethyl 3-(methylthio)-2-propenoate, (2Z)-, ethyl (Z)-3-methylsulfanylprop-2-enoate, 2-Propenoic acid, 3-(methylthio)-, ethyl ester, (Z)-
| Molecular Formula | C6H10O2S |
|---|---|
| Molecular Weight | 146.04 g/mol |
| LogP | 1.4262 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.04015 |
| Heavy Atoms | 9 |
| Complexity | 109.62549 |
Chemical Identifiers
| CAS Number | 136115-66-7 |
|---|---|
| SMILES | CCOC(=O)/C=C\SC |
Product Overview
Ethyl 3-(methylthio)-2-propenoate, (2Z)- (CAS 136115-66-7), with molecular formula C6H10O2S and molecular weight 146.04 g/mol. IUPAC: ethyl (Z)-3-methylsulfanylprop-2-enoate.
Chemical Property Profile of Ethyl 3-(methylthio)-2-propenoate, (2Z)-
Property Insights of Ethyl 3-(methylthio)-2-propenoate, (2Z)-
The XLogP value of 1.4262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(methylthio)-2-propenoate, (2Z)-. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 3-(methylthio)-2-propenoate, (2Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(methylthio)-2-propenoate, (2Z)- 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 Ethyl 3-(methylthio)-2-propenoate, (2Z)-?
The CAS number of Ethyl 3-(methylthio)-2-propenoate, (2Z)- is 136115-66-7.
What is the molecular formula of Ethyl 3-(methylthio)-2-propenoate, (2Z)-?
The molecular formula of Ethyl 3-(methylthio)-2-propenoate, (2Z)- is C6H10O2S.
What is the molecular weight of Ethyl 3-(methylthio)-2-propenoate, (2Z)-?
The molecular weight of Ethyl 3-(methylthio)-2-propenoate, (2Z)- is 146.04 g/mol.
Where can I buy Ethyl 3-(methylthio)-2-propenoate, (2Z)-?
You can request a quote for Ethyl 3-(methylthio)-2-propenoate, (2Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(methylthio)-2-propenoate, (2Z)-?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(methylthio)-2-propenoate, (2Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.