![6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione structure](/static/products/4118/4118-33-6.webp)
6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione
TL;DR: 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS 4118-33-6) is a chemical compound with molecular formula C13H8ClNO2 and molecular weight 245.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-methylbenzo[de]isoquinoline-1,3-dione
Also Known As: 4-chloro-N-methyl-1,8-naphthalimide, N-Methyl-1-chloronaphthalene-4,5-dicarbimide, 6-Chloro-2-methyl-benzo[de]isoquinoline-1,3-d ione, 6-chloro-2-methylbenzo[de]isoquinoline-1,3-dione, 6-Chloro-2-methyl-benzo[de]isoquinoline-1,3-dione
| Molecular Formula | C13H8ClNO2 |
|---|---|
| Molecular Weight | 245.02 g/mol |
| LogP | 2.719 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.02435 |
| Heavy Atoms | 17 |
| Complexity | 656.16895 |
Chemical Identifiers
| CAS Number | 4118-33-6 |
|---|---|
| SMILES | CN1C(=O)C2=C3C(=C(C=C2)Cl)C=CC=C3C1=O |
Product Overview
6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS 4118-33-6), with molecular formula C13H8ClNO2 and molecular weight 245.02 g/mol. IUPAC: 6-chloro-2-methylbenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione
Property Insights of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione
The XLogP value of 2.719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione 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 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione?
The CAS number of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione is 4118-33-6.
What is the molecular formula of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione?
The molecular formula of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione is C13H8ClNO2.
What is the molecular weight of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione?
The molecular weight of 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione is 245.02 g/mol.
Where can I buy 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione?
You can request a quote for 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.