2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)
TL;DR: 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) (CAS 23958-95-4) is a chemical compound with molecular formula C12H18ClNO4 and molecular weight 275.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxy-3-methoxybenzoyl)oxyethyl-dimethylazanium chloride
Also Known As: 2-Hydroxy-3-methoxybenzoic acid hydrochloride, 2-(dimethylamino)ethyl ester, BENZOIC ACID, 2-HYDROXY-3-METHOXY-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE, 2-(2-hydroxy-3-methoxybenzoyl)oxyethyl-dimethylazanium chloride, m-Anisic acid, 2-hydroxy-, 2-(dimethylamino)ethyl ester, hydrochloride, 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)
| Molecular Formula | C12H18ClNO4 |
|---|---|
| Molecular Weight | 275.09 g/mol |
| LogP | -3.29 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.09244 |
| Heavy Atoms | 18 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 23958-95-4 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)C1=C(C(=CC=C1)OC)O.[Cl-] |
| InChIKey | PFLMCXUYRDKVFU-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) (CAS 23958-95-4), with molecular formula C12H18ClNO4 and molecular weight 275.09 g/mol. IUPAC: 2-(2-hydroxy-3-methoxybenzoyl)oxyethyl-dimethylazanium chloride.
Chemical Property Profile of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)
Property Insights of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)
The XLogP value of -3.29 indicates that 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) has 2 hydrogen bond donor(s) and 5 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-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)?
The CAS number of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) is 23958-95-4.
What is the molecular formula of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)?
The molecular formula of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) is C12H18ClNO4.
What is the molecular weight of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)?
The molecular weight of 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) is 275.09 g/mol.
Where can I buy 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)?
You can request a quote for 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--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-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)ethyl 2-hydroxy-3-methoxybenzoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.