[(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb
TL;DR: [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb (CAS 73622-94-3) is a chemical compound with molecular formula C8H4Cl6N2O6 and molecular weight 433.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenylcarbamoyl 2,2,2-trichloroacetate
Also Known As: [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb|Acetic acid, hexachloro-, dianhydride with N,N'-vinylene dicarbamic acid|2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenylcarbamoyl 2,2,2-trichloroacetate
| Molecular Formula | C8H4Cl6N2O6 |
|---|---|
| Molecular Weight | 433.82 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.8171 |
| Heavy Atoms | 22 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 73622-94-3 |
|---|---|
| SMILES | C(=CNC(=O)OC(=O)C(Cl)(Cl)Cl)NC(=O)OC(=O)C(Cl)(Cl)Cl |
| InChIKey | GXZJIIBMRRATHK-UHFFFAOYSA-N |
Product Overview
[(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb (CAS 73622-94-3), with molecular formula C8H4Cl6N2O6 and molecular weight 433.82 g/mol. IUPAC: 2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenylcarbamoyl 2,2,2-trichloroacetate.
Chemical Property Profile of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb
Property Insights of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb. Following Lipinski's Rule of Five, [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb has 2 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 [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb?
The CAS number of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb is 73622-94-3.
What is the molecular formula of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb?
The molecular formula of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb is C8H4Cl6N2O6.
What is the molecular weight of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb?
The molecular weight of [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb is 433.82 g/mol.
Where can I buy [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb?
You can request a quote for [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb?
Yes, KEHONG BIO provides custom synthesis services for [(E)-2-[(2,2,2-trichloroacetyl)oxycarbonylamino]ethenyl]carb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.