Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide
TL;DR: Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide (CAS 6755-01-7) is a chemical compound with molecular formula C14H19NO6 and molecular weight 297.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(dimethylamino)-2-oxoethyl] 3,4,5-trimethoxybenzoate
Also Known As: TOAM, BENZOIC ACID, 3,4,5-TRIMETHOXY-, ESTER with N,N-DIMETHYLGLYCOLAMIDE, 3,4,5-Trimethoxybenzoic acid ester with N,N-dimethylglycolamide, 2-(Dimethylamino)-2-oxoethyl 3,4,5-trimethoxybenzoate, [2-(dimethylamino)-2-oxoethyl] 3,4,5-trimethoxybenzoate
| Molecular Formula | C14H19NO6 |
|---|---|
| Molecular Weight | 297.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 297.12125 |
| Heavy Atoms | 21 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 6755-01-7 |
|---|---|
| SMILES | CN(C)C(=O)COC(=O)C1=CC(=C(C(=C1)OC)OC)OC |
| InChIKey | JTGXNCOSEVWXPT-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide (CAS 6755-01-7), with molecular formula C14H19NO6 and molecular weight 297.12 g/mol. IUPAC: [2-(dimethylamino)-2-oxoethyl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide
Property Insights of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide. Following Lipinski's Rule of Five, Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide has 0 hydrogen bond donor(s) and 6 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-, ester with N,N-dimethylglycolamide?
The CAS number of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide is 6755-01-7.
What is the molecular formula of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide?
The molecular formula of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide is C14H19NO6.
What is the molecular weight of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide?
The molecular weight of Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide is 297.12 g/mol.
Where can I buy Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide?
You can request a quote for Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide 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-, ester with N,N-dimethylglycolamide?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,4,5-trimethoxy-, ester with N,N-dimethylglycolamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.