2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸
TL;DR: 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 (CAS 60705-96-6) is a chemical compound with molecular formula C10H7NO4 and molecular weight 205.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸
2-(2,3-dioxoindol-1-yl)acetic acid
Also Known As: Isatinessigsaure, (2,3-Dioxo-2,3-dihydro-indol-1-yl)-acetic acid, 2-(2,3-dioxoindolin-1-yl)acetic acid, -ACETICACID, (2,3-Dioxo-2,3-dihydro-1H-indol-1-yl)acetic acid
| Molecular Formula | C10H7NO4 |
|---|---|
| Molecular Weight | 205.04 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.0375 |
| Heavy Atoms | 15 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 60705-96-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=O)N2CC(=O)O |
| InChIKey | KYAMYNWIAQNFEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 (CAS 60705-96-6), with molecular formula C10H7NO4 and molecular weight 205.04 g/mol. IUPAC: 2-(2,3-dioxoindol-1-yl)acetic acid.
Chemical Property Profile of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸
Property Insights of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸. Following Lipinski's Rule of Five, 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 has 1 hydrogen bond donor(s) and 4 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-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸?
The CAS number of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 is 60705-96-6.
What is the molecular formula of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸?
The molecular formula of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 is C10H7NO4.
What is the molecular weight of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸?
The molecular weight of 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 is 205.04 g/mol.
Where can I buy 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸?
You can request a quote for 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-二氧代-2,3-二氢-1H-吲哚-1-基)乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.