RefChem:316160
TL;DR: RefChem:316160 (CAS 52073-13-9) is a chemical compound with molecular formula C19H29NO5 and molecular weight 351.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[2-(dimethylamino)ethoxy]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate
Also Known As: Acetic acid, (2-ethoxycarbonyl-6-isopropyl-3-methyl)phenoxy-, 2-(dimethylamino)ethyl ester, p-Cymene-2-carboxylic acid, 3-(2-dimethylamino)ethoxycarbonylmethoxy-, ethyl ester, ethyl 2-{2-[2-(dimethylamino)ethoxy]-2-oxoethoxy}-6-methyl-3-(propan-2-yl)benzoate, (2-Ethoxycarbonyl -6-isopropyl -3-methylphenoxy)acetic acid 2-(dimethylamino)ethyl ester, (2-Ethoxycarbonyl-6-isopropyl-3-methylphenoxy)acetic acid 2-(dimethylamino)ethyl ester
| Molecular Formula | C19H29NO5 |
|---|---|
| Molecular Weight | 351.20 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 351.20456 |
| Heavy Atoms | 25 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 52073-13-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1OCC(=O)OCCN(C)C)C(C)C)C |
| InChIKey | LXACVVADKCRIQI-UHFFFAOYSA-N |
Product Overview
RefChem:316160 (CAS 52073-13-9), with molecular formula C19H29NO5 and molecular weight 351.20 g/mol. IUPAC: ethyl 2-[2-[2-(dimethylamino)ethoxy]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate.
Chemical Property Profile of RefChem:316160
Property Insights of RefChem:316160
The XLogP value of 3.6 indicates that RefChem:316160 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316160. Following Lipinski's Rule of Five, RefChem:316160 has 0 hydrogen bond donor(s) and 6 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 RefChem:316160?
The CAS number of RefChem:316160 is 52073-13-9.
What is the molecular formula of RefChem:316160?
The molecular formula of RefChem:316160 is C19H29NO5.
What is the molecular weight of RefChem:316160?
The molecular weight of RefChem:316160 is 351.20 g/mol.
Where can I buy RefChem:316160?
You can request a quote for RefChem:316160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316160?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.