Propanoic acid, 2-allyloxy-, ethyl ester
TL;DR: Propanoic acid, 2-allyloxy-, ethyl ester (CAS 134180-60-2) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-prop-2-enoxypropanoate
Also Known As: ethyl 2-allyloxypropionate, Ethyl 2-(allyloxy)propanoate, ethyl 2-prop-2-enoxypropanoate, Ethyl 2-(allyloxy)propanoate #, Ethyl (RS)-2-allyloxy-propionate
| Molecular Formula | C8H14O3 |
|---|---|
| Molecular Weight | 158.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.0943 |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 134180-60-2 |
|---|---|
| SMILES | CCOC(=O)C(C)OCC=C |
| InChIKey | SQKHGJLWNLPYMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanoic acid, 2-allyloxy-, ethyl ester (CAS 134180-60-2), with molecular formula C8H14O3 and molecular weight 158.09 g/mol. IUPAC: ethyl 2-prop-2-enoxypropanoate.
Chemical Property Profile of Propanoic acid, 2-allyloxy-, ethyl ester
Property Insights of Propanoic acid, 2-allyloxy-, ethyl ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanoic acid, 2-allyloxy-, ethyl ester. With a topological polar surface area (TPSA) of 35.5 Ų, Propanoic acid, 2-allyloxy-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2-allyloxy-, ethyl 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 Propanoic acid, 2-allyloxy-, ethyl ester?
The CAS number of Propanoic acid, 2-allyloxy-, ethyl ester is 134180-60-2.
What is the molecular formula of Propanoic acid, 2-allyloxy-, ethyl ester?
The molecular formula of Propanoic acid, 2-allyloxy-, ethyl ester is C8H14O3.
What is the molecular weight of Propanoic acid, 2-allyloxy-, ethyl ester?
The molecular weight of Propanoic acid, 2-allyloxy-, ethyl ester is 158.09 g/mol.
Where can I buy Propanoic acid, 2-allyloxy-, ethyl ester?
You can request a quote for Propanoic acid, 2-allyloxy-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-allyloxy-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-allyloxy-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.