(Z)-3-Pentenoic acid, methyl ester
TL;DR: (Z)-3-Pentenoic acid, methyl ester (CAS 36781-66-5) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (Z)-pent-3-enoate
Also Known As: methyl cis-3-pentenoate, methyl (Z)-pent-3-enoate, Methyl (3Z)-3-pentenoate, (Z)-3-Pentenoic acid, methyl ester, Methyl (3Z)-3-pentenoate #
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | 1.1256 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 94.70166 |
Chemical Identifiers
| CAS Number | 36781-66-5 |
|---|---|
| SMILES | C/C=C\CC(=O)OC |
Product Overview
(Z)-3-Pentenoic acid, methyl ester (CAS 36781-66-5), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: methyl (Z)-pent-3-enoate.
Chemical Property Profile of (Z)-3-Pentenoic acid, methyl ester
Property Insights of (Z)-3-Pentenoic acid, methyl ester
The XLogP value of 1.1256 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-Pentenoic acid, methyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, (Z)-3-Pentenoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-Pentenoic acid, methyl ester has 0 hydrogen bond donor(s) and 2 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 (Z)-3-Pentenoic acid, methyl ester?
The CAS number of (Z)-3-Pentenoic acid, methyl ester is 36781-66-5.
What is the molecular formula of (Z)-3-Pentenoic acid, methyl ester?
The molecular formula of (Z)-3-Pentenoic acid, methyl ester is C6H10O2.
What is the molecular weight of (Z)-3-Pentenoic acid, methyl ester?
The molecular weight of (Z)-3-Pentenoic acid, methyl ester is 114.07 g/mol.
Where can I buy (Z)-3-Pentenoic acid, methyl ester?
You can request a quote for (Z)-3-Pentenoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-Pentenoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-Pentenoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.