Octahydro-1H-indole
TL;DR: Octahydro-1H-indole (CAS 4375-14-8) is a chemical compound with molecular formula C8H15N and molecular weight 125.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3a,4,5,6,7,7a-octahydro-1H-indole
Also Known As: Octahydro-1H-indole, Octahydroindole, Perhydroindole, Octahydro-indol, 1H-Indole, octahydro-
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 4375-14-8 |
|---|---|
| SMILES | C1CCC2C(C1)CCN2 |
| InChIKey | PDELQDSYLBLPQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octahydro-1H-indole (CAS 4375-14-8), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: 2,3,3a,4,5,6,7,7a-octahydro-1H-indole.
Chemical Property Profile of Octahydro-1H-indole
Property Insights of Octahydro-1H-indole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octahydro-1H-indole. With a topological polar surface area (TPSA) of 12.0 Ų, Octahydro-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octahydro-1H-indole 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 Octahydro-1H-indole?
The CAS number of Octahydro-1H-indole is 4375-14-8.
What is the molecular formula of Octahydro-1H-indole?
The molecular formula of Octahydro-1H-indole is C8H15N.
What is the molecular weight of Octahydro-1H-indole?
The molecular weight of Octahydro-1H-indole is 125.12 g/mol.
Where can I buy Octahydro-1H-indole?
You can request a quote for Octahydro-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octahydro-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for Octahydro-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.