2-chloro-5-nitro-1H-indole-3-carbaldehyde
TL;DR: 2-chloro-5-nitro-1H-indole-3-carbaldehyde (CAS 117752-76-8) is a chemical compound with molecular formula C9H5ClN2O3 and molecular weight 224.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-nitro-1H-indole-3-carbaldehyde
Also Known As: 2-chloro-5-nitro-1H-indole-3-carbaldehyde, 2-Chloro-5-nitroindole-3-carbaldehyde, 2-chloro-5-nitro-1h-indole-3-carboxaldehyde
| Molecular Formula | C9H5ClN2O3 |
|---|---|
| Molecular Weight | 224.00 g/mol |
| LogP | 2.542 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.99887 |
| Heavy Atoms | 15 |
| Complexity | 561.72797 |
Chemical Identifiers
| CAS Number | 117752-76-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=C(N2)Cl)C=O |
Product Overview
2-chloro-5-nitro-1H-indole-3-carbaldehyde (CAS 117752-76-8), with molecular formula C9H5ClN2O3 and molecular weight 224.00 g/mol. IUPAC: 2-chloro-5-nitro-1H-indole-3-carbaldehyde.
Chemical Property Profile of 2-chloro-5-nitro-1H-indole-3-carbaldehyde
Property Insights of 2-chloro-5-nitro-1H-indole-3-carbaldehyde
The XLogP value of 2.542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-5-nitro-1H-indole-3-carbaldehyde. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-5-nitro-1H-indole-3-carbaldehyde. Following Lipinski's Rule of Five, 2-chloro-5-nitro-1H-indole-3-carbaldehyde 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 2-chloro-5-nitro-1H-indole-3-carbaldehyde?
The CAS number of 2-chloro-5-nitro-1H-indole-3-carbaldehyde is 117752-76-8.
What is the molecular formula of 2-chloro-5-nitro-1H-indole-3-carbaldehyde?
The molecular formula of 2-chloro-5-nitro-1H-indole-3-carbaldehyde is C9H5ClN2O3.
What is the molecular weight of 2-chloro-5-nitro-1H-indole-3-carbaldehyde?
The molecular weight of 2-chloro-5-nitro-1H-indole-3-carbaldehyde is 224.00 g/mol.
Where can I buy 2-chloro-5-nitro-1H-indole-3-carbaldehyde?
You can request a quote for 2-chloro-5-nitro-1H-indole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-5-nitro-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-5-nitro-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.