Indole-2,3-dione, 1-(hydroxymethyl)-
TL;DR: Indole-2,3-dione, 1-(hydroxymethyl)- (CAS 50899-59-7) is a chemical compound with molecular formula C9H7NO3 and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(hydroxymethyl)indole-2,3-dione
Also Known As: 1-Hydroxymethyl-1H-indole-2,3-dione, N-Hydroxymethylisatin, 1-(Hydroxymethyl)indole-2,3-dione, 1-(hydroxymethyl)indoline-2,3-dione, Hydroxymethylisatin
| Molecular Formula | C9H7NO3 |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.04259 |
| Heavy Atoms | 13 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 50899-59-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=O)N2CO |
| InChIKey | MHGOPQDELUOKPE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indole-2,3-dione, 1-(hydroxymethyl)- (CAS 50899-59-7), with molecular formula C9H7NO3 and molecular weight 177.04 g/mol. IUPAC: 1-(hydroxymethyl)indole-2,3-dione.
Chemical Property Profile of Indole-2,3-dione, 1-(hydroxymethyl)-
Property Insights of Indole-2,3-dione, 1-(hydroxymethyl)-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-2,3-dione, 1-(hydroxymethyl)-. With a topological polar surface area (TPSA) of 57.6 Ų, Indole-2,3-dione, 1-(hydroxymethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-2,3-dione, 1-(hydroxymethyl)- has 1 hydrogen bond donor(s) and 3 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 Indole-2,3-dione, 1-(hydroxymethyl)-?
The CAS number of Indole-2,3-dione, 1-(hydroxymethyl)- is 50899-59-7.
What is the molecular formula of Indole-2,3-dione, 1-(hydroxymethyl)-?
The molecular formula of Indole-2,3-dione, 1-(hydroxymethyl)- is C9H7NO3.
What is the molecular weight of Indole-2,3-dione, 1-(hydroxymethyl)-?
The molecular weight of Indole-2,3-dione, 1-(hydroxymethyl)- is 177.04 g/mol.
Where can I buy Indole-2,3-dione, 1-(hydroxymethyl)-?
You can request a quote for Indole-2,3-dione, 1-(hydroxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole-2,3-dione, 1-(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Indole-2,3-dione, 1-(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.