5-Chloro-6-nitro-1,2-dihydroacenaphthylene
TL;DR: 5-Chloro-6-nitro-1,2-dihydroacenaphthylene (CAS 104035-78-1) is a chemical compound with molecular formula C12H8ClNO2 and molecular weight 233.02435 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-6-nitro-1,2-dihydroacenaphthylene
Also Known As: 5-chloro-6-nitro-acenaphthene, 5-chloro-6-nitro-1,2-dihydroacenaphthylene
Technical Specifications
| Molecular Formula | C12H8ClNO2 |
| Molecular Weight | 233.02435 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.02435 Da |
| Heavy Atoms | 16 |
| Complexity | 304.0 |
| SMILES | C1CC2=CC=C(C3=C(C=CC1=C23)[N+](=O)[O-])Cl |
| InChIKey | OOVYBCUCHVLWPK-UHFFFAOYSA-N |
Chemical Property Profile of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene
Property Insights of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene
The XLogP value of 4.5 indicates that 5-Chloro-6-nitro-1,2-dihydroacenaphthylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 5-Chloro-6-nitro-1,2-dihydroacenaphthylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-6-nitro-1,2-dihydroacenaphthylene 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
What is the CAS number of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene?
The CAS number of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene is 104035-78-1.
What is the molecular formula of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene?
The molecular formula of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene is C12H8ClNO2.
What is the molecular weight of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene?
The molecular weight of 5-Chloro-6-nitro-1,2-dihydroacenaphthylene is 233.02435 g/mol.
Where can I buy 5-Chloro-6-nitro-1,2-dihydroacenaphthylene?
You can request a quote for 5-Chloro-6-nitro-1,2-dihydroacenaphthylene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Chloro-6-nitro-1,2-dihydroacenaphthylene?
Yes, CoreyChem provides custom synthesis services for 5-Chloro-6-nitro-1,2-dihydroacenaphthylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.