2-Methyl-3-oxoisoindoline-4-carboxylic acid
TL;DR: 2-Methyl-3-oxoisoindoline-4-carboxylic acid (CAS 14262-20-5) is a chemical compound with molecular formula C10H9NO3 and molecular weight 191.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-oxo-1H-isoindole-4-carboxylic acid
Also Known As: 2-methyl-3-oxoisoindoline-4-carboxylic acid, ChemDiv2_001670, 2-methyl-3-oxo-1H-isoindole-4-carboxylic acid, 2-METHYL-3-OXO-2,3-DIHYDRO-1H-ISOINDOLE-4-CARBOXYLIC ACID, 2-Methyl-3-oxo-4-isoindolinecarboxylic acid
| Molecular Formula | C10H9NO3 |
|---|---|
| Molecular Weight | 191.06 g/mol |
| LogP | 0.9704 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.05824 |
| Heavy Atoms | 14 |
| Complexity | 425.37534 |
Chemical Identifiers
| CAS Number | 14262-20-5 |
|---|---|
| SMILES | CN1CC2=C(C1=O)C(=CC=C2)C(=O)O |
Product Overview
2-Methyl-3-oxoisoindoline-4-carboxylic acid (CAS 14262-20-5), with molecular formula C10H9NO3 and molecular weight 191.06 g/mol. IUPAC: 2-methyl-3-oxo-1H-isoindole-4-carboxylic acid.
Chemical Property Profile of 2-Methyl-3-oxoisoindoline-4-carboxylic acid
Property Insights of 2-Methyl-3-oxoisoindoline-4-carboxylic acid
The XLogP value of 0.9704 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-oxoisoindoline-4-carboxylic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 2-Methyl-3-oxoisoindoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-oxoisoindoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 2 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-Methyl-3-oxoisoindoline-4-carboxylic acid?
The CAS number of 2-Methyl-3-oxoisoindoline-4-carboxylic acid is 14262-20-5.
What is the molecular formula of 2-Methyl-3-oxoisoindoline-4-carboxylic acid?
The molecular formula of 2-Methyl-3-oxoisoindoline-4-carboxylic acid is C10H9NO3.
What is the molecular weight of 2-Methyl-3-oxoisoindoline-4-carboxylic acid?
The molecular weight of 2-Methyl-3-oxoisoindoline-4-carboxylic acid is 191.06 g/mol.
Where can I buy 2-Methyl-3-oxoisoindoline-4-carboxylic acid?
You can request a quote for 2-Methyl-3-oxoisoindoline-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-oxoisoindoline-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-oxoisoindoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.