ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate
TL;DR: ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate (CAS 54545-50-5) is a chemical compound with molecular formula C12H17O6- and molecular weight 257.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate
Also Known As: (C6-H8-O4.C4-H6-O2.C2-H4)x-, 2-Butenedioic acid (Z)-, monoethyl ester, polymer with ethene and methyl 2-propenoate, ethene; (Z)-4-ethoxy-4-oxobut-2-enoic acid; 2-methylprop-2-enoate, 2-Butenedioic acid (2Z)-, 1-ethyl ester, polymer with ethene and methyl 2-propenoate, 2-Butenedioic acid (2Z)-, monoethyl ester, polymer with ethene and methyl 2-propenoate
| Molecular Formula | C12H17O6- |
|---|---|
| Molecular Weight | 257.10 g/mol |
| LogP | 0.3049 |
| Topological Polar Surface Area | 103.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.1025 |
| Heavy Atoms | 18 |
| Complexity | 304.52933 |
Chemical Identifiers
| CAS Number | 54545-50-5 |
|---|---|
| SMILES | CCOC(=O)/C=C\C(=O)O.CC(=C)C(=O)[O-].C=C |
Product Overview
ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate (CAS 54545-50-5), with molecular formula C12H17O6- and molecular weight 257.10 g/mol. IUPAC: ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate.
Chemical Property Profile of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate
Property Insights of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate
The XLogP value of 0.3049 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate. The TPSA of 103.73 Ų falls within the moderate polarity range, balancing permeability and solubility for ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate. Following Lipinski's Rule of Five, ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate has 1 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 ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate?
The CAS number of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate is 54545-50-5.
What is the molecular formula of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate?
The molecular formula of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate is C12H17O6-.
What is the molecular weight of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate?
The molecular weight of ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate is 257.10 g/mol.
Where can I buy ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate?
You can request a quote for ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethene;(Z)-4-ethoxy-4-oxobut-2-enoic acid;2-methylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.