4-Nitro-1,2-dihydroacenaphthylene
TL;DR: 4-Nitro-1,2-dihydroacenaphthylene (CAS 1015-74-3) is a chemical compound with molecular formula C12H9NO2 and molecular weight 199.06332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-nitro-1,2-dihydroacenaphthylene
Also Known As: 4-nitroacenaphthene, 4-nitro-1,2-dihydroacenaphthylene, Acenaphthene, 4-nitro-, Acenaphthylene,2-dihydro-4-nitro-, Acenaphthylene, 1,2-dihydro-4-nitro-
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H9NO2 |
| Molecular Weight | 199.06332 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.06332 Da |
| Heavy Atoms | 15 |
| Complexity | 273.0 |
| SMILES | C1CC2=C3C1=CC=CC3=CC(=C2)[N+](=O)[O-] |
| InChIKey | NPNRZUBMQUTWPW-UHFFFAOYSA-N |
Chemical Property Profile of 4-Nitro-1,2-dihydroacenaphthylene
Property Insights of 4-Nitro-1,2-dihydroacenaphthylene
The XLogP value of 3.3 indicates that 4-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, 4-Nitro-1,2-dihydroacenaphthylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-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 4-Nitro-1,2-dihydroacenaphthylene?
The CAS number of 4-Nitro-1,2-dihydroacenaphthylene is 1015-74-3.
What is the molecular formula of 4-Nitro-1,2-dihydroacenaphthylene?
The molecular formula of 4-Nitro-1,2-dihydroacenaphthylene is C12H9NO2.
What is the molecular weight of 4-Nitro-1,2-dihydroacenaphthylene?
The molecular weight of 4-Nitro-1,2-dihydroacenaphthylene is 199.06332 g/mol.
Where can I buy 4-Nitro-1,2-dihydroacenaphthylene?
You can request a quote for 4-Nitro-1,2-dihydroacenaphthylene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Nitro-1,2-dihydroacenaphthylene?
Yes, CoreyChem provides custom synthesis services for 4-Nitro-1,2-dihydroacenaphthylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.