2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester
TL;DR: 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester (CAS 7596-87-4) is a chemical compound with molecular formula C20H20O6 and molecular weight 356.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-phenoxyethyl) (Z)-but-2-enedioate
Also Known As: Di(phenoxyethyl) maleate, Bis(2-phenoxyethyl) maleate, bis(2-phenoxyethyl) (Z)-but-2-enedioate, bis(2-phenoxyethyl) but-2-enedioate, 2-Butenedioic acid (2Z)-, bis(2-phenoxyethyl) ester
| Molecular Formula | C20H20O6 |
|---|---|
| Molecular Weight | 356.13 g/mol |
| LogP | 2.787 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 356.12598 |
| Heavy Atoms | 26 |
| Complexity | 635.25604 |
Chemical Identifiers
| CAS Number | 7596-87-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCOC(=O)/C=C\C(=O)OCCOC2=CC=CC=C2 |
Product Overview
2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester (CAS 7596-87-4), with molecular formula C20H20O6 and molecular weight 356.13 g/mol. IUPAC: bis(2-phenoxyethyl) (Z)-but-2-enedioate.
Chemical Property Profile of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester
Property Insights of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester
The XLogP value of 2.787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester. Following Lipinski's Rule of Five, 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester has 0 hydrogen bond donor(s) and 6 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 (2Z)-, 1,4-bis(2-phenoxyethyl) ester?
The CAS number of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester is 7596-87-4.
What is the molecular formula of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester?
The molecular formula of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester is C20H20O6.
What is the molecular weight of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester?
The molecular weight of 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester is 356.13 g/mol.
Where can I buy 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester?
You can request a quote for 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) 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 (2Z)-, 1,4-bis(2-phenoxyethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenedioic acid (2Z)-, 1,4-bis(2-phenoxyethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.