2-Nitronaphtho(1,8-bc)pyran
TL;DR: 2-Nitronaphtho(1,8-bc)pyran (CAS 105052-38-8) is a chemical compound with molecular formula C12H7NO3 and molecular weight 213.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-nitro-2-oxatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaene
Also Known As: 2-Nitronaphtho(1,8-bc)pyran, 2-nitrobenzo[de]chromene, 2-nitro naphtho(1,8-bc)pyran, 2-NITRONAPHTHO[1,8-BC]PYRAN, NAPHTHO(1,8-bc)PYRAN, 2-NITRO-
Technical Specifications
| Molecular Formula | C12H7NO3 |
| Molecular Weight | 213.04259 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.04259 Da |
| Heavy Atoms | 16 |
| Complexity | 334.0 |
| SMILES | C1=CC2=C3C(=C1)C=C(OC3=CC=C2)[N+](=O)[O-] |
| InChIKey | GGXRZUFEHAUOEV-UHFFFAOYSA-N |
Chemical Property Profile of 2-Nitronaphtho(1,8-bc)pyran
Property Insights of 2-Nitronaphtho(1,8-bc)pyran
The XLogP value of 3.3 indicates that 2-Nitronaphtho(1,8-bc)pyran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 2-Nitronaphtho(1,8-bc)pyran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Nitronaphtho(1,8-bc)pyran has 0 hydrogen bond donor(s) and 3 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-Nitronaphtho(1,8-bc)pyran?
The CAS number of 2-Nitronaphtho(1,8-bc)pyran is 105052-38-8.
What is the molecular formula of 2-Nitronaphtho(1,8-bc)pyran?
The molecular formula of 2-Nitronaphtho(1,8-bc)pyran is C12H7NO3.
What is the molecular weight of 2-Nitronaphtho(1,8-bc)pyran?
The molecular weight of 2-Nitronaphtho(1,8-bc)pyran is 213.04259 g/mol.
Where can I buy 2-Nitronaphtho(1,8-bc)pyran?
You can request a quote for 2-Nitronaphtho(1,8-bc)pyran directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Nitronaphtho(1,8-bc)pyran?
Yes, CoreyChem provides custom synthesis services for 2-Nitronaphtho(1,8-bc)pyran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.