2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester
TL;DR: 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester (CAS 25876-47-5) is a chemical compound with molecular formula C9H12O5 and molecular weight 200.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-ethyl 4-O-(oxiran-2-ylmethyl) (Z)-but-2-enedioate
Also Known As: Ethyl glycidyl fumarate, ethyl glycidyl maleate, Ethyl 2,3-epoxypropyl fumarate, FUMARIC ACID, ETHYL 2,3-EPOXYPROPYL ESTER, 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester
| Molecular Formula | C9H12O5 |
|---|---|
| Molecular Weight | 200.07 g/mol |
| LogP | 0.0477 |
| Topological Polar Surface Area | 65.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 200.06847 |
| Heavy Atoms | 14 |
| Complexity | 241.58687 |
Chemical Identifiers
| CAS Number | 25876-47-5 |
|---|---|
| SMILES | CCOC(=O)/C=C\C(=O)OCC1CO1 |
Product Overview
2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester (CAS 25876-47-5), with molecular formula C9H12O5 and molecular weight 200.07 g/mol. IUPAC: 1-O-ethyl 4-O-(oxiran-2-ylmethyl) (Z)-but-2-enedioate.
Chemical Property Profile of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester
Property Insights of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester
The XLogP value of 0.0477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester. The TPSA of 65.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester. Following Lipinski's Rule of Five, 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester has 0 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 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester?
The CAS number of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester is 25876-47-5.
What is the molecular formula of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester?
The molecular formula of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester is C9H12O5.
What is the molecular weight of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester?
The molecular weight of 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester is 200.07 g/mol.
Where can I buy 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester?
You can request a quote for 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenedioic acid (E)-, ethyl oxiranylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.