Trimethyl-1H-indole
TL;DR: Trimethyl-1H-indole (CAS 30642-36-5) is a chemical compound with molecular formula C22H26N2 and molecular weight 318.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,7-trimethyl-1H-indole;4,6,7-trimethyl-1H-indole
Also Known As: TRIMETHYL-1H-INDOLE, Ketone,heptyl methyl, 1H-Indole, trimethyl-, 3,4,7-trimethyl-1H-indole,4,6,7-trimethyl-1H-indole, 3,4,7-trimethyl-1H-indole; 4,6,7-trimethyl-1H-indole
| Molecular Formula | C22H26N2 |
|---|---|
| Molecular Weight | 318.21 g/mol |
| LogP | 6.19 |
| Topological Polar Surface Area | 31.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 318.2096 |
| Heavy Atoms | 24 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 30642-36-5 |
|---|---|
| SMILES | CC1=C2C(=CNC2=C(C=C1)C)C.CC1=CC(=C2C=CNC2=C1C)C |
| InChIKey | ZLBQDFFUJTUPQR-UHFFFAOYSA-N |
Product Overview
Trimethyl-1H-indole (CAS 30642-36-5), with molecular formula C22H26N2 and molecular weight 318.21 g/mol. IUPAC: 3,4,7-trimethyl-1H-indole;4,6,7-trimethyl-1H-indole.
Chemical Property Profile of Trimethyl-1H-indole
Property Insights of Trimethyl-1H-indole
The XLogP value of 6.19 indicates that Trimethyl-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.6 Ų, Trimethyl-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethyl-1H-indole has 2 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trimethyl-1H-indole?
The CAS number of Trimethyl-1H-indole is 30642-36-5.
What is the molecular formula of Trimethyl-1H-indole?
The molecular formula of Trimethyl-1H-indole is C22H26N2.
What is the molecular weight of Trimethyl-1H-indole?
The molecular weight of Trimethyl-1H-indole is 318.21 g/mol.
Where can I buy Trimethyl-1H-indole?
You can request a quote for Trimethyl-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethyl-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for Trimethyl-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.