Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-
TL;DR: Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- (CAS 63938-02-3) is a chemical compound with molecular formula C18H24N2O2 and molecular weight 300.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-1-[2-(4-nitrophenyl)ethyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline
Also Known As: 2-METHYL-1-(4-NITROPHENETHYL)-1,2,3,4,5,6,7,8-OCTAHYDROISOQUINOLINE, 5-20-07-00535 (Beilstein Handbook Reference), 1-(4-Nitrophenethyl)-2-methyl-1,2,3,4,5,6,7,8-octahydroisoquinoline, 2-Methyl-1-[2-(4-nitrophenyl)ethyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline, ISOQUINOLINE, 1,2,3,4,5,6,7,8-OCTAHYDRO-2-METHYL-1-(4-NITROPHENETHYL)-
Technical Specifications
| Molecular Formula | C18H24N2O2 |
| Molecular Weight | 300.18378 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.18378 Da |
| Heavy Atoms | 22 |
| Complexity | 433.0 |
| SMILES | CN1CCC2=C(C1CCC3=CC=C(C=C3)[N+](=O)[O-])CCCC2 |
| InChIKey | NHZSGFPRDZNUNP-UHFFFAOYSA-N |
Chemical Property Profile of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-
Property Insights of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-
The XLogP value of 3.6 indicates that Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-?
The CAS number of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- is 63938-02-3.
What is the molecular formula of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-?
The molecular formula of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- is C18H24N2O2.
What is the molecular weight of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-?
The molecular weight of Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- is 300.18378 g/mol.
Where can I buy Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-?
You can request a quote for Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)-?
Yes, CoreyChem provides custom synthesis services for Isoquinoline, 1,2,3,4,5,6,7,8-octahydro-2-methyl-1-(4-nitrophenethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.