Indole-3-Carboxaldehyde
TL;DR: Indole-3-Carboxaldehyde (CAS 487-89-8) is a chemical compound with molecular formula C9H7NO and molecular weight 145.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-indole-3-carbaldehyde
Also Known As: INDOLE-3-CARBOXALDEHYDE, 1H-Indole-3-carbaldehyde, 3-Formylindole, Indole-3-aldehyde, Indole-3-carbaldehyde
| Molecular Formula | C9H7NO |
|---|---|
| Molecular Weight | 145.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.05276 |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
| Melting Point | 197 - 199 °C |
| Vapor Pressure | 0.00043 [mmHg] |
Chemical Identifiers
| CAS Number | 487-89-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C=O |
| InChIKey | OLNJUISKUQQNIM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indole-3-Carboxaldehyde (CAS 487-89-8), with molecular formula C9H7NO and molecular weight 145.05 g/mol. IUPAC: 1H-indole-3-carbaldehyde.
Chemical Property Profile of Indole-3-Carboxaldehyde
Property Insights of Indole-3-Carboxaldehyde
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-3-Carboxaldehyde. With a topological polar surface area (TPSA) of 32.9 Ų, Indole-3-Carboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-3-Carboxaldehyde has 1 hydrogen bond donor(s) and 1 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-3-Carboxaldehyde?
The CAS number of Indole-3-Carboxaldehyde is 487-89-8.
What is the molecular formula of Indole-3-Carboxaldehyde?
The molecular formula of Indole-3-Carboxaldehyde is C9H7NO.
What is the molecular weight of Indole-3-Carboxaldehyde?
The molecular weight of Indole-3-Carboxaldehyde is 145.05 g/mol.
Where can I buy Indole-3-Carboxaldehyde?
You can request a quote for Indole-3-Carboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indole-3-Carboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Indole-3-Carboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.