3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one
TL;DR: 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one (CAS 29879-69-4) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-methyl-3H-isoindol-1-one
Also Known As: 3-hydroxy-2-methylisoindolin-1-one, 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one, 3-hydroxy-2-methyl-1-isoindolinone, 3-hydroxy-2-methyl-2,3-dihydro-isoindol-1-one, 3-hydroxy-2-methyl-3H-isoindol-1-one
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 0.7631 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 335.05536 |
Chemical Identifiers
| CAS Number | 29879-69-4 |
|---|---|
| SMILES | CN1C(C2=CC=CC=C2C1=O)O |
Product Overview
3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one (CAS 29879-69-4), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: 3-hydroxy-2-methyl-3H-isoindol-1-one.
Chemical Property Profile of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one
Property Insights of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one
The XLogP value of 0.7631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one. With a topological polar surface area (TPSA) of 40.54 Ų, 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one 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 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one?
The CAS number of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one is 29879-69-4.
What is the molecular formula of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one?
The molecular formula of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one is C9H9NO2.
What is the molecular weight of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one?
The molecular weight of 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one is 163.06 g/mol.
Where can I buy 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one?
You can request a quote for 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxy-2-methyl-2,3-dihydro-1H-isoindol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.