1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester
TL;DR: 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester (CAS 33975-36-9) is a chemical compound with molecular formula C21H29NO4 and molecular weight 359.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodecyl 1,3-dioxoisoindole-5-carboxylate
Also Known As: Trimellitimide lauryl ester, dodecyl 1,3-dioxoisoindole-5-carboxylate, 5-Isoindolinecarboxylic acid, 1,3-dioxo-, dodecyl ester, Dodecyl 1,3-dioxo-5-isoindolinecarboxylate #, 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester
| Molecular Formula | C21H29NO4 |
|---|---|
| Molecular Weight | 359.21 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 359.20966 |
| Heavy Atoms | 26 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 33975-36-9 |
|---|---|
| SMILES | CCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)NC2=O |
| InChIKey | AYCPVHUVOLALSQ-UHFFFAOYSA-N |
Product Overview
1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester (CAS 33975-36-9), with molecular formula C21H29NO4 and molecular weight 359.21 g/mol. IUPAC: dodecyl 1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester
Property Insights of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester
The XLogP value of 6.2 indicates that 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester. Following Lipinski's Rule of Five, 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester?
The CAS number of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester is 33975-36-9.
What is the molecular formula of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester?
The molecular formula of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester is C21H29NO4.
What is the molecular weight of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester?
The molecular weight of 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester is 359.21 g/mol.
Where can I buy 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester?
You can request a quote for 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-, dodecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.