![2-[(Diethylamino)methyl]-6-methylphenyl benzoate structure](/static/products/920/92017-23-7.png)
2-[(Diethylamino)methyl]-6-methylphenyl benzoate
TL;DR: 2-[(Diethylamino)methyl]-6-methylphenyl benzoate (CAS 92017-23-7) is a chemical compound with molecular formula C19H23NO2 and molecular weight 297.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(diethylaminomethyl)-6-methylphenyl] benzoate
Also Known As: NCIOpen2_002454, 2-[(diethylamino)methyl]-6-methylphenyl benzoate, [2-(diethylaminomethyl)-6-methylphenyl] benzoate
| Molecular Formula | C19H23NO2 |
|---|---|
| Molecular Weight | 297.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 297.17288 |
| Heavy Atoms | 22 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 92017-23-7 |
|---|---|
| SMILES | CCN(CC)CC1=CC=CC(=C1OC(=O)C2=CC=CC=C2)C |
| InChIKey | HOTGTTARNWRLKO-UHFFFAOYSA-N |
Product Overview
2-[(Diethylamino)methyl]-6-methylphenyl benzoate (CAS 92017-23-7), with molecular formula C19H23NO2 and molecular weight 297.17 g/mol. IUPAC: [2-(diethylaminomethyl)-6-methylphenyl] benzoate.
Chemical Property Profile of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate
Property Insights of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate
The XLogP value of 4.3 indicates that 2-[(Diethylamino)methyl]-6-methylphenyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-[(Diethylamino)methyl]-6-methylphenyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Diethylamino)methyl]-6-methylphenyl benzoate has 0 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-[(Diethylamino)methyl]-6-methylphenyl benzoate?
The CAS number of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate is 92017-23-7.
What is the molecular formula of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate?
The molecular formula of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate is C19H23NO2.
What is the molecular weight of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate?
The molecular weight of 2-[(Diethylamino)methyl]-6-methylphenyl benzoate is 297.17 g/mol.
Where can I buy 2-[(Diethylamino)methyl]-6-methylphenyl benzoate?
You can request a quote for 2-[(Diethylamino)methyl]-6-methylphenyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Diethylamino)methyl]-6-methylphenyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Diethylamino)methyl]-6-methylphenyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.