Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate
TL;DR: Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate (CAS 522652-27-3) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2,2,4-trimethyl-1H-quinolin-6-yl) carbonate
Also Known As: BAS 05590289, ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate, ethyl (2,2,4-trimethyl-1H-quinolin-6-yl) carbonate, 2,2,4-trimethyl-6-1,2-dihydroquinolyl ethoxyformate, ethyl (2,2,4-trimethyl-1,2-dihydro-6-quinolinyl) carbonate
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 3.8293 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 532.19226 |
Chemical Identifiers
| CAS Number | 522652-27-3 |
|---|---|
| SMILES | CCOC(=O)OC1=CC2=C(C=C1)NC(C=C2C)(C)C |
Product Overview
Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate (CAS 522652-27-3), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: ethyl (2,2,4-trimethyl-1H-quinolin-6-yl) carbonate.
Chemical Property Profile of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate
Property Insights of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate
The XLogP value of 3.8293 indicates that Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate 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 Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate?
The CAS number of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate is 522652-27-3.
What is the molecular formula of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate?
The molecular formula of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate is C15H19NO3.
What is the molecular weight of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate?
The molecular weight of Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate is 261.14 g/mol.
Where can I buy Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate?
You can request a quote for Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.