bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate
TL;DR: bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate (CAS 39006-81-0) is a chemical compound with molecular formula C16H6Cl4N2O8 and molecular weight 493.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate
Also Known As: bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate, Bis(2,4-dichloro-6-nitrophenyl) (2E)-but-2-enedioate
| Molecular Formula | C16H6Cl4N2O8 |
|---|---|
| Molecular Weight | 493.89 g/mol |
| LogP | 5.1838 |
| Topological Polar Surface Area | 138.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.88782 |
| Heavy Atoms | 30 |
| Complexity | 1017.638 |
Chemical Identifiers
| CAS Number | 39006-81-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])OC(=O)/C=C/C(=O)OC2=C(C=C(C=C2Cl)Cl)[N+](=O)[O-])Cl)Cl |
Product Overview
bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate (CAS 39006-81-0), with molecular formula C16H6Cl4N2O8 and molecular weight 493.89 g/mol. IUPAC: bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate.
Chemical Property Profile of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate
Property Insights of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate
The XLogP value of 5.1838 indicates that bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.88 Ų falls within the moderate polarity range, balancing permeability and solubility for bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate. Following Lipinski's Rule of Five, bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate?
The CAS number of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate is 39006-81-0.
What is the molecular formula of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate?
The molecular formula of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate is C16H6Cl4N2O8.
What is the molecular weight of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate?
The molecular weight of bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate is 493.89 g/mol.
Where can I buy bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate?
You can request a quote for bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for bis(2,4-dichloro-6-nitrophenyl) (E)-but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.