8-(Methoxymethyl)-1-methylisoquinoline
TL;DR: 8-(Methoxymethyl)-1-methylisoquinoline (CAS 136602-83-0) is a chemical compound with molecular formula C12H13NO and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(methoxymethyl)-1-methylisoquinoline
Also Known As: 8-(methoxymethyl)-1-methylisoquinoline, 1-Methyl-8-(methoxymethyl)isoquinoline, Isoquinoline, 8-(methoxymethyl)-1-methyl-
| Molecular Formula | C12H13NO |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 22.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.09972 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 136602-83-0 |
|---|---|
| SMILES | CC1=NC=CC2=C1C(=CC=C2)COC |
| InChIKey | BDYXSKJZXQFDLJ-UHFFFAOYSA-N |
Product Overview
8-(Methoxymethyl)-1-methylisoquinoline (CAS 136602-83-0), with molecular formula C12H13NO and molecular weight 187.10 g/mol. IUPAC: 8-(methoxymethyl)-1-methylisoquinoline.
Chemical Property Profile of 8-(Methoxymethyl)-1-methylisoquinoline
Property Insights of 8-(Methoxymethyl)-1-methylisoquinoline
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(Methoxymethyl)-1-methylisoquinoline. With a topological polar surface area (TPSA) of 22.1 Ų, 8-(Methoxymethyl)-1-methylisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(Methoxymethyl)-1-methylisoquinoline has 0 hydrogen bond donor(s) and 2 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 8-(Methoxymethyl)-1-methylisoquinoline?
The CAS number of 8-(Methoxymethyl)-1-methylisoquinoline is 136602-83-0.
What is the molecular formula of 8-(Methoxymethyl)-1-methylisoquinoline?
The molecular formula of 8-(Methoxymethyl)-1-methylisoquinoline is C12H13NO.
What is the molecular weight of 8-(Methoxymethyl)-1-methylisoquinoline?
The molecular weight of 8-(Methoxymethyl)-1-methylisoquinoline is 187.10 g/mol.
Where can I buy 8-(Methoxymethyl)-1-methylisoquinoline?
You can request a quote for 8-(Methoxymethyl)-1-methylisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(Methoxymethyl)-1-methylisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-(Methoxymethyl)-1-methylisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.