Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-
TL;DR: Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- (CAS 14429-09-5) is a chemical compound with molecular formula C11H15N and molecular weight 161.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-3,4-dihydro-1H-isoquinoline
Also Known As: 1,2-Dimethyl-1,2,3,4-tetrahydroisoquinoline, 1,2,3,4-Tetrahydro-1,2-dimethylisoquinoline, 1,2-dimethyl-3,4-dihydro-1H-isoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-, 1,2-dimethyl-3,4-dihydroisoquinoline
| Molecular Formula | C11H15N |
|---|---|
| Molecular Weight | 161.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.12045 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 14429-09-5 |
|---|---|
| SMILES | CC1C2=CC=CC=C2CCN1C |
| InChIKey | ANEGOXNGPXRGPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- (CAS 14429-09-5), with molecular formula C11H15N and molecular weight 161.12 g/mol. IUPAC: 1,2-dimethyl-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-
Property Insights of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-. With a topological polar surface area (TPSA) of 3.2 Ų, Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- 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
Frequently Asked Questions
What is the CAS number of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-?
The CAS number of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- is 14429-09-5.
What is the molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-?
The molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- is C11H15N.
What is the molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-?
The molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- is 161.12 g/mol.
Where can I buy Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-?
You can request a quote for Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 1,2,3,4-tetrahydro-1,2-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.