Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
TL;DR: Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) (CAS 92726-06-2) is a chemical compound with molecular formula C15H24ClNO2 and molecular weight 285.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dimethylbenzoyl)oxyethyl-diethylazanium chloride
Also Known As: 2,3-Dimethylbenzoic acid 2-(diethylamino)ethyl ester hydrochloride, 2-Diethylaminoethyl 2,3-dimethylbenzoate hydrochloride, 2-(2,3-dimethylbenzoyl)oxyethyl-diethylazanium chloride, BENZOIC ACID, 2,3-DIMETHYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE, Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
| Molecular Formula | C15H24ClNO2 |
|---|---|
| Molecular Weight | 285.15 g/mol |
| LogP | -1.61 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 285.14957 |
| Heavy Atoms | 19 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 92726-06-2 |
|---|---|
| SMILES | CC[NH+](CC)CCOC(=O)C1=CC=CC(=C1C)C.[Cl-] |
| InChIKey | UIGUISYLUSMVES-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) (CAS 92726-06-2), with molecular formula C15H24ClNO2 and molecular weight 285.15 g/mol. IUPAC: 2-(2,3-dimethylbenzoyl)oxyethyl-diethylazanium chloride.
Chemical Property Profile of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
Property Insights of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
The XLogP value of -1.61 indicates that Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (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, Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (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 Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The CAS number of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is 92726-06-2.
What is the molecular formula of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The molecular formula of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is C15H24ClNO2.
What is the molecular weight of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
The molecular weight of Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) is 285.15 g/mol.
Where can I buy Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
You can request a quote for Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2,3-dimethyl-, 2-(diethylamino)ethyl ester, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.