2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)
TL;DR: 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) (CAS 2014-29-1) is a chemical compound with molecular formula C15H22ClNO3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dimethylphenyl) 2-morpholin-4-ylpropanoate;hydrochloride
Also Known As: alpha-Methyl-4-morpholineacetic acid 2,6-xylyl ester hydrochloride, 2,6-dimethylphenyl 2-(morpholin-4-yl)propanoate hydrochloride(1:1), (2,6-dimethylphenyl) 2-morpholin-4-ylpropanoate hydrochloride, 2,6-Dimethylphenyl 2-(4-morpholinyl)propanoate hydrochloride, 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)
| Molecular Formula | C15H22ClNO3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 2.35 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.1288 |
| Heavy Atoms | 20 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 2014-29-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)OC(=O)C(C)N2CCOCC2.Cl |
| InChIKey | VZZSWICIHCIGAL-UHFFFAOYSA-N |
Product Overview
2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) (CAS 2014-29-1), with molecular formula C15H22ClNO3 and molecular weight 299.13 g/mol. IUPAC: (2,6-dimethylphenyl) 2-morpholin-4-ylpropanoate;hydrochloride.
Chemical Property Profile of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)
Property Insights of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)
The XLogP value of 2.35 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 38.8 Ų, 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 4 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 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)?
The CAS number of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) is 2014-29-1.
What is the molecular formula of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)?
The molecular formula of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) is C15H22ClNO3.
What is the molecular weight of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)?
The molecular weight of 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) is 299.13 g/mol.
Where can I buy 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)?
You can request a quote for 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--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 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethylphenyl 2-(morpholin-4-yl)propanoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.