1H-Indole, 1-butyl-2-methyl-
TL;DR: 1H-Indole, 1-butyl-2-methyl- (CAS 42951-35-9) is a chemical compound with molecular formula C13H17N and molecular weight 187.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2-methylindole
Also Known As: 1-butyl-2-methylindole, 1-Butyl-2-methyl-1H-indole, 1H-Indole, 1-butyl-2-methyl-, 1- butyl-2-methylindole, 1-n-butyl-2-methylindole
| Molecular Formula | C13H17N |
|---|---|
| Molecular Weight | 187.14 g/mol |
| LogP | 3.74982 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.1361 |
| Heavy Atoms | 14 |
| Complexity | 425.7282 |
Chemical Identifiers
| CAS Number | 42951-35-9 |
|---|---|
| SMILES | CCCCN1C(=CC2=CC=CC=C21)C |
Product Overview
1H-Indole, 1-butyl-2-methyl- (CAS 42951-35-9), with molecular formula C13H17N and molecular weight 187.14 g/mol. IUPAC: 1-butyl-2-methylindole.
Chemical Property Profile of 1H-Indole, 1-butyl-2-methyl-
Property Insights of 1H-Indole, 1-butyl-2-methyl-
The XLogP value of 3.74982 indicates that 1H-Indole, 1-butyl-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, 1H-Indole, 1-butyl-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 1-butyl-2-methyl- has 0 hydrogen bond donor(s) and 0 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, 1-butyl-2-methyl-?
The CAS number of 1H-Indole, 1-butyl-2-methyl- is 42951-35-9.
What is the molecular formula of 1H-Indole, 1-butyl-2-methyl-?
The molecular formula of 1H-Indole, 1-butyl-2-methyl- is C13H17N.
What is the molecular weight of 1H-Indole, 1-butyl-2-methyl-?
The molecular weight of 1H-Indole, 1-butyl-2-methyl- is 187.14 g/mol.
Where can I buy 1H-Indole, 1-butyl-2-methyl-?
You can request a quote for 1H-Indole, 1-butyl-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole, 1-butyl-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole, 1-butyl-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.