Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride
TL;DR: Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride (CAS 108479-29-4) is a chemical compound with molecular formula C17H26ClNO6 and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-morpholin-4-ylpropyl 3,4,5-trimethoxybenzoate;hydrochloride
Also Known As: 3,4,5-Trimethoxybenzoic acid 3-morpholinopropyl ester hydrochloride, 4-Morpholinepropanol, 3,4,5-trimethoxybenzoate hydrochloride, BENZOIC ACID, 3,4,5-TRIMETHOXY-, 3-MORPHOLINOPROPYL ESTER, HYDROCHLORIDE, 3-morpholin-4-ylpropyl 3,4,5-trimethoxybenzoate hydrochloride, Chlorowodorek estru gamma-N-morfolinopropylowego kwasu 3,4,5-trojmetylogalusowego [Polish]
| Molecular Formula | C17H26ClNO6 |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 2.01 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 375.14487 |
| Heavy Atoms | 25 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 108479-29-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)OCCCN2CCOCC2.Cl |
| InChIKey | GMHAGTDFPYMPGE-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride (CAS 108479-29-4), with molecular formula C17H26ClNO6 and molecular weight 375.14 g/mol. IUPAC: 3-morpholin-4-ylpropyl 3,4,5-trimethoxybenzoate;hydrochloride.
Chemical Property Profile of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride
Property Insights of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride
The XLogP value of 2.01 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride. Following Lipinski's Rule of Five, Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride has 1 hydrogen bond donor(s) and 7 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, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride?
The CAS number of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride is 108479-29-4.
What is the molecular formula of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride?
The molecular formula of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride is C17H26ClNO6.
What is the molecular weight of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride?
The molecular weight of Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride is 375.14 g/mol.
Where can I buy Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride?
You can request a quote for Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,4,5-trimethoxy-, 3-morpholinopropyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.