5-Methyl-2-phenyloctahydro-1H-isoindole
TL;DR: 5-Methyl-2-phenyloctahydro-1H-isoindole (CAS 65021-81-0) is a chemical compound with molecular formula C15H21N and molecular weight 215.1674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-2-phenyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
Also Known As: 5-Methyl-2-phenylhexahydroisoindoline, 5-methyl-2-phenyloctahydro-1H-isoindole, Hexahydro-5-methyl-2-phenylisoindoline, 5-methyl-2-phenyl-octahydro-1H-isoindole, ISOINDOLINE, HEXAHYDRO-5-METHYL-2-PHENYL-
Technical Specifications
| Molecular Formula | C15H21N |
| Molecular Weight | 215.1674 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.1674 Da |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
| SMILES | CC1CCC2CN(CC2C1)C3=CC=CC=C3 |
| InChIKey | HCUHWVPLUKTLLT-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methyl-2-phenyloctahydro-1H-isoindole
Property Insights of 5-Methyl-2-phenyloctahydro-1H-isoindole
The XLogP value of 4.2 indicates that 5-Methyl-2-phenyloctahydro-1H-isoindole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 5-Methyl-2-phenyloctahydro-1H-isoindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-phenyloctahydro-1H-isoindole 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
What is the CAS number of 5-Methyl-2-phenyloctahydro-1H-isoindole?
The CAS number of 5-Methyl-2-phenyloctahydro-1H-isoindole is 65021-81-0.
What is the molecular formula of 5-Methyl-2-phenyloctahydro-1H-isoindole?
The molecular formula of 5-Methyl-2-phenyloctahydro-1H-isoindole is C15H21N.
What is the molecular weight of 5-Methyl-2-phenyloctahydro-1H-isoindole?
The molecular weight of 5-Methyl-2-phenyloctahydro-1H-isoindole is 215.1674 g/mol.
Where can I buy 5-Methyl-2-phenyloctahydro-1H-isoindole?
You can request a quote for 5-Methyl-2-phenyloctahydro-1H-isoindole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methyl-2-phenyloctahydro-1H-isoindole?
Yes, CoreyChem provides custom synthesis services for 5-Methyl-2-phenyloctahydro-1H-isoindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.