Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester
TL;DR: Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester (CAS 73790-22-4) is a chemical compound with molecular formula C12H10Cl2O5 and molecular weight 303.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl (E)-2-(2,4-dichlorophenoxy)but-2-enedioate
Also Known As: Dimethyl (2,4-dichlorophenoxy) butenedioate, (2,4-Dichlorophenoxy)butenedioic acid dimethyl ester, BUTENEDIOIC ACID, (2,4-DICHLOROPHENOXY)-, DIMETHYL ESTER, dimethyl (E)-2-(2,4-dichlorophenoxy)but-2-enedioate, 2-Butenedioic acid, 2-(2,4-dichlorophenoxy)-, dimethyl ester
| Molecular Formula | C12H10Cl2O5 |
|---|---|
| Molecular Weight | 303.99 g/mol |
| LogP | 2.6021 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.99054 |
| Heavy Atoms | 19 |
| Complexity | 524.8511 |
Chemical Identifiers
| CAS Number | 73790-22-4 |
|---|---|
| SMILES | COC(=O)/C=C(\C(=O)OC)/OC1=C(C=C(C=C1)Cl)Cl |
Product Overview
Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester (CAS 73790-22-4), with molecular formula C12H10Cl2O5 and molecular weight 303.99 g/mol. IUPAC: dimethyl (E)-2-(2,4-dichlorophenoxy)but-2-enedioate.
Chemical Property Profile of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester
Property Insights of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester
The XLogP value of 2.6021 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester. Following Lipinski's Rule of Five, Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl 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 Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester?
The CAS number of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester is 73790-22-4.
What is the molecular formula of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester?
The molecular formula of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester is C12H10Cl2O5.
What is the molecular weight of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester?
The molecular weight of Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester is 303.99 g/mol.
Where can I buy Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester?
You can request a quote for Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butenedioic acid, (2,4-dichlorophenoxy)-, dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.