Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester
TL;DR: Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester (CAS 85221-17-6) is a chemical compound with molecular formula C15H11Cl2NO3 and molecular weight 323.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetylphenyl) N-(3,4-dichlorophenyl)carbamate
Also Known As: 4-acetylphenyl (3,4-dichlorophenyl)carbamate, (4-acetylphenyl) N-(3,4-dichlorophenyl)carbamate, Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester, 4-acetylphenyl(3,4-dichlorophenyl)carbamate, 4-ACETYLPHENYL N-(3,4-DICHLOROPHENYL)CARBAMATE
| Molecular Formula | C15H11Cl2NO3 |
|---|---|
| Molecular Weight | 323.01 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.0116 |
| Heavy Atoms | 21 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 85221-17-6 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | SVADXMBEHYZPGI-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester (CAS 85221-17-6), with molecular formula C15H11Cl2NO3 and molecular weight 323.01 g/mol. IUPAC: (4-acetylphenyl) N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester
Property Insights of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester
The XLogP value of 4.8 indicates that Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester has 1 hydrogen bond donor(s) and 3 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 Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester?
The CAS number of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester is 85221-17-6.
What is the molecular formula of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester?
The molecular formula of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester is C15H11Cl2NO3.
What is the molecular weight of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester?
The molecular weight of Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester is 323.01 g/mol.
Where can I buy Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester?
You can request a quote for Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3,4-dichlorophenyl)-, 4-acetylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.