2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)
TL;DR: 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) (CAS 2085-83-8) is a chemical compound with molecular formula C20H26ClNO2 and molecular weight 347.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,6-dimethylphenoxy)-2-oxo-1-phenylethyl]-diethylazanium chloride
Also Known As: [2-(2,6-dimethylphenoxy)-2-oxo-1-phenylethyl]-diethylazanium chloride|N,N-Diethyl-2-phenyl-glycine 2,6-xylyl ester hydrochloride|GLYCINE, N,N-DIETHYL-2-PHENYL-, 2,6-XYLYL ESTER, HYDROCHLORIDE|[2-(2,6-dimethylphenoxy)-2-oxo-1-phenylethyl]-diethylazanium,chloride|2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)|RefChem:1060281|DTXCID801371484
| Molecular Formula | C20H26ClNO2 |
|---|---|
| Molecular Weight | 347.17 g/mol |
| LogP | -0.12 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.1652 |
| Heavy Atoms | 24 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 2085-83-8 |
|---|---|
| SMILES | CC[NH+](CC)C(C1=CC=CC=C1)C(=O)OC2=C(C=CC=C2C)C.[Cl-] |
| InChIKey | XLLNWRAHBKXRQE-UHFFFAOYSA-N |
Product Overview
2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) (CAS 2085-83-8), with molecular formula C20H26ClNO2 and molecular weight 347.17 g/mol. IUPAC: [2-(2,6-dimethylphenoxy)-2-oxo-1-phenylethyl]-diethylazanium chloride.
Chemical Property Profile of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)
Property Insights of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)
The XLogP value of -0.12 indicates that 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) 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 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The CAS number of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) is 2085-83-8.
What is the molecular formula of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The molecular formula of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) is C20H26ClNO2.
What is the molecular weight of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The molecular weight of 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) is 347.17 g/mol.
Where can I buy 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)?
You can request a quote for 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethylphenyl (diethylamino)(phenyl)acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.