2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde
TL;DR: 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde (CAS 64788-58-5) is a chemical compound with molecular formula C13H14ClNO and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(2-methylpropyl)indole-3-carbaldehyde
Also Known As: 2-chloro-1-(2-methylpropyl)indole-3-carbaldehyde, 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde, 1H-INDOLE-3-CARBOXALDEHYDE,2-CHLORO-1-(2-METHYLPROPYL)-
| Molecular Formula | C13H14ClNO |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.07639 |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 64788-58-5 |
|---|---|
| SMILES | CC(C)CN1C2=CC=CC=C2C(=C1Cl)C=O |
| InChIKey | PATWCWHGWOKXSH-UHFFFAOYSA-N |
Product Overview
2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde (CAS 64788-58-5), with molecular formula C13H14ClNO and molecular weight 235.08 g/mol. IUPAC: 2-chloro-1-(2-methylpropyl)indole-3-carbaldehyde.
Chemical Property Profile of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde
Property Insights of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde
The XLogP value of 3.7 indicates that 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.0 Ų, 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde has 0 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 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde?
The CAS number of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde is 64788-58-5.
What is the molecular formula of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde?
The molecular formula of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde is C13H14ClNO.
What is the molecular weight of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde?
The molecular weight of 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde is 235.08 g/mol.
Where can I buy 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde?
You can request a quote for 2-Chloro-1-(2-methylpropyl)-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-1-(2-methylpropyl)-1H-indole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-(2-methylpropyl)-1H-indole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.