1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate
TL;DR: 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate (CAS 106320-92-7) is a chemical compound with molecular formula C14H18ClNO4 and molecular weight 299.09244 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate
Also Known As: 1-(carbobutoxy)ethyl n-(3-chlorophenyl)carbamate, butyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate, Butyl 2-(((3-chlorophenyl)carbamoyl)oxy)propanoate, butyl 2-{[(3-chloroanilino)carbonyl]oxy}propanoate, butyl 2-{[(3-chlorophenyl)carbamoyl]oxy}propanoate
Technical Specifications
| Molecular Formula | C14H18ClNO4 |
| Molecular Weight | 299.09244 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 299.09244 Da |
| Heavy Atoms | 20 |
| Complexity | 324.0 |
| SMILES | CCCCOC(=O)C(C)OC(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | NTQRSNGITNDNRT-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate
Property Insights of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate
The XLogP value of 3.7 indicates that 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate 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 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate. Following Lipinski's Rule of Five, 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate 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
What is the CAS number of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate?
The CAS number of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate is 106320-92-7.
What is the molecular formula of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate?
The molecular formula of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate is C14H18ClNO4.
What is the molecular weight of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate?
The molecular weight of 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate is 299.09244 g/mol.
Where can I buy 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate?
You can request a quote for 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate?
Yes, CoreyChem provides custom synthesis services for 1-(Carbobutoxy)ethyl N-(3-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.