2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate
TL;DR: 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate (CAS 71043-64-6) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,4-trimethyl-1H-quinolin-6-yl) acetate
Also Known As: 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl acetate, (2,2,4-trimethyl-1H-quinolin-6-yl) acetate, BAS 00388447, 2,2,4-trimethyl-1H-quinolin-6-yl acetate, 2,2,4-trimethyl-6-1,2-dihydroquinolyl acetate
| Molecular Formula | C14H17NO2 |
|---|---|
| Molecular Weight | 231.13 g/mol |
| LogP | 3.2193 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.12593 |
| Heavy Atoms | 17 |
| Complexity | 500.94373 |
Chemical Identifiers
| CAS Number | 71043-64-6 |
|---|---|
| SMILES | CC1=CC(NC2=C1C=C(C=C2)OC(=O)C)(C)C |
Product Overview
2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate (CAS 71043-64-6), with molecular formula C14H17NO2 and molecular weight 231.13 g/mol. IUPAC: (2,2,4-trimethyl-1H-quinolin-6-yl) acetate.
Chemical Property Profile of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate
Property Insights of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate
The XLogP value of 3.2193 indicates that 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate 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 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate?
The CAS number of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate is 71043-64-6.
What is the molecular formula of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate?
The molecular formula of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate is C14H17NO2.
What is the molecular weight of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate?
The molecular weight of 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate is 231.13 g/mol.
Where can I buy 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate?
You can request a quote for 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethyl-1,2-dihydroquinolin-6-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.