1H-Indole-3-carboxaldehyde Oxime
TL;DR: 1H-Indole-3-carboxaldehyde Oxime (CAS 2592-05-4) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-indol-3-ylmethylidene)hydroxylamine
Also Known As: 1H-indole-3-carbaldehyde oxime, indole-3-aldoxime, 3-Indolaldehyde Oxime, Maybridge1_000132, ChemDiv2_000193
| Molecular Formula | C9H8N2O |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 2592-05-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C=NO |
| InChIKey | BWEFEUTYNRSOKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indole-3-carboxaldehyde Oxime (CAS 2592-05-4), with molecular formula C9H8N2O and molecular weight 160.06 g/mol. IUPAC: N-(1H-indol-3-ylmethylidene)hydroxylamine.
Chemical Property Profile of 1H-Indole-3-carboxaldehyde Oxime
Property Insights of 1H-Indole-3-carboxaldehyde Oxime
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-3-carboxaldehyde Oxime. With a topological polar surface area (TPSA) of 48.4 Ų, 1H-Indole-3-carboxaldehyde Oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-3-carboxaldehyde Oxime has 2 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 1H-Indole-3-carboxaldehyde Oxime?
The CAS number of 1H-Indole-3-carboxaldehyde Oxime is 2592-05-4.
What is the molecular formula of 1H-Indole-3-carboxaldehyde Oxime?
The molecular formula of 1H-Indole-3-carboxaldehyde Oxime is C9H8N2O.
What is the molecular weight of 1H-Indole-3-carboxaldehyde Oxime?
The molecular weight of 1H-Indole-3-carboxaldehyde Oxime is 160.06 g/mol.
Where can I buy 1H-Indole-3-carboxaldehyde Oxime?
You can request a quote for 1H-Indole-3-carboxaldehyde Oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-3-carboxaldehyde Oxime?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-3-carboxaldehyde Oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.