Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide
TL;DR: Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide (CAS 790-90-9) is a chemical compound with molecular formula C11H10Cl3NO4 and molecular weight 324.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetamidophenyl) 2,2,2-trichloroethyl carbonate
Also Known As: 4-Acetamidophenyl 2,2,2-trichloroethyl carbonate, CARBONIC ACID, 2,2,2-TRICHLOROETHYL ESTER, ESTER with 4'-HYDROXYACETANILIDE, (4-acetamidophenyl) 2,2,2-trichloroethyl carbonate, Carbonic acid, 4-(acetylamino)phenyl 2,2,2-trichloroethyl ester, Acetamide, N-(p-hydroxyphenyl)-, 2,2,2-trichloroethyl carbonate
| Molecular Formula | C11H10Cl3NO4 |
|---|---|
| Molecular Weight | 324.97 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.96753 |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 790-90-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OC(=O)OCC(Cl)(Cl)Cl |
| InChIKey | GZCRJHAVDRUHET-UHFFFAOYSA-N |
Product Overview
Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide (CAS 790-90-9), with molecular formula C11H10Cl3NO4 and molecular weight 324.97 g/mol. IUPAC: (4-acetamidophenyl) 2,2,2-trichloroethyl carbonate.
Chemical Property Profile of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide
Property Insights of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide
The XLogP value of 3.1 indicates that Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide. Following Lipinski's Rule of Five, Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide has 1 hydrogen bond donor(s) and 4 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 Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide?
The CAS number of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide is 790-90-9.
What is the molecular formula of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide?
The molecular formula of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide is C11H10Cl3NO4.
What is the molecular weight of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide?
The molecular weight of Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide is 324.97 g/mol.
Where can I buy Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide?
You can request a quote for Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, 2,2,2-trichloroethyl ester, ester with 4'-hydroxyacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.