o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride
TL;DR: o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride (CAS 63209-46-1) is a chemical compound with molecular formula C14H22ClNO2 and molecular weight 271.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-methylbenzoate;hydrochloride
Also Known As: o-Toluic acid, hydrochloride, o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride, 2-diethylaminoethyl 2-methylbenzoate hydrochloride, Benzoic acid, 2-methyl-, 2-(diethylamino)ethyl ester, hydrochloride, Benzoic acid, 2-(diethylamino)ethyl ester, hydrochloride
| Molecular Formula | C14H22ClNO2 |
|---|---|
| Molecular Weight | 271.13 g/mol |
| LogP | 2.91542 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.1339 |
| Heavy Atoms | 18 |
| Complexity | 364.56656 |
Chemical Identifiers
| CAS Number | 63209-46-1 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=CC=C1C.Cl |
Product Overview
o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride (CAS 63209-46-1), with molecular formula C14H22ClNO2 and molecular weight 271.13 g/mol. IUPAC: 2-(diethylamino)ethyl 2-methylbenzoate;hydrochloride.
Chemical Property Profile of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride
Property Insights of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride
The XLogP value of 2.91542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride. With a topological polar surface area (TPSA) of 29.54 Ų, o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride 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 o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride?
The CAS number of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride is 63209-46-1.
What is the molecular formula of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride?
The molecular formula of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride is C14H22ClNO2.
What is the molecular weight of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride?
The molecular weight of o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride is 271.13 g/mol.
Where can I buy o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride?
You can request a quote for o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for o-Toluic acid, 2-(diethylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.