2-Nitro-7,8,9,10,11,12-hexahydrochrysene
TL;DR: 2-Nitro-7,8,9,10,11,12-hexahydrochrysene (CAS 141511-29-7) is a chemical compound with molecular formula C18H17NO2 and molecular weight 279.12592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-nitro-1,2,3,4,5,6-hexahydrochrysene
Also Known As: 2-Nitro-7,8,9,10,11,12-hexahydrochrysene, 8-nitro-1,2,3,4,5,6-hexahydrochrysene, 7,8,9,10,11,12-Hexahydro-2-nitrochrysene, Chrysene, 1,2,3,4,5,6-hexahydro-8-nitro-, Chrysene, 7,8,9,10,11,12-hexahydro-2-nitro-
Technical Specifications
| Molecular Formula | C18H17NO2 |
| Molecular Weight | 279.12592 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 279.12592 Da |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
| SMILES | C1CCC2=C(C1)C=CC3=C2CCC4=C3C=CC(=C4)[N+](=O)[O-] |
| InChIKey | YNAHHYXTVAAJLP-UHFFFAOYSA-N |
Chemical Property Profile of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene
Property Insights of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene
The XLogP value of 5.0 indicates that 2-Nitro-7,8,9,10,11,12-hexahydrochrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 2-Nitro-7,8,9,10,11,12-hexahydrochrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Nitro-7,8,9,10,11,12-hexahydrochrysene 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 2-Nitro-7,8,9,10,11,12-hexahydrochrysene?
The CAS number of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene is 141511-29-7.
What is the molecular formula of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene?
The molecular formula of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene is C18H17NO2.
What is the molecular weight of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene?
The molecular weight of 2-Nitro-7,8,9,10,11,12-hexahydrochrysene is 279.12592 g/mol.
Where can I buy 2-Nitro-7,8,9,10,11,12-hexahydrochrysene?
You can request a quote for 2-Nitro-7,8,9,10,11,12-hexahydrochrysene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Nitro-7,8,9,10,11,12-hexahydrochrysene?
Yes, CoreyChem provides custom synthesis services for 2-Nitro-7,8,9,10,11,12-hexahydrochrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.