6-Bromoisoquinoline
TL;DR: 6-Bromoisoquinoline (CAS 1099772-09-4) is a chemical compound with molecular formula C9H6BrN and molecular weight 206.96835 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromoisoquinoline
Also Known As: 6-bromoisoquinoline, isoquinoline, 6-bromo-, 6-Bromo-isoquinoline, null, 6-bromo isoquinoline
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H6BrN |
| Molecular Weight | 206.96835 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.96835 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| SMILES | C1=CC2=C(C=CN=C2)C=C1Br |
| InChIKey | ZTEATMVVGQUULZ-UHFFFAOYSA-N |
Chemical Property Profile of 6-Bromoisoquinoline
Property Insights of 6-Bromoisoquinoline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Bromoisoquinoline. With a topological polar surface area (TPSA) of 12.9 Ų, 6-Bromoisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromoisoquinoline 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 6-Bromoisoquinoline?
The CAS number of 6-Bromoisoquinoline is 1099772-09-4.
What is the molecular formula of 6-Bromoisoquinoline?
The molecular formula of 6-Bromoisoquinoline is C9H6BrN.
What is the molecular weight of 6-Bromoisoquinoline?
The molecular weight of 6-Bromoisoquinoline is 206.96835 g/mol.
Where can I buy 6-Bromoisoquinoline?
You can request a quote for 6-Bromoisoquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Bromoisoquinoline?
Yes, CoreyChem provides custom synthesis services for 6-Bromoisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.