TL;DR: NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- (CAS 86539-63-1) is a chemical compound with molecular formula C12H7NO4 and molecular weight 229.0375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-nitrobenzo[e][1]benzofuran-7-ol
Also Known As: 2-Nitronaphtho(2,1-b)furan-7-ol, 2-nitronaphtho[2,1-b]furan-7-ol, 2-Nitro-7-hydroxynaphtho(2,1-b)furan, 2-nitrobenzo[e][1]benzofuran-7-ol, NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO-
| Molecular Formula | C12H7NO4 |
| Molecular Weight | 229.0375 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.0375 Da |
| Heavy Atoms | 17 |
| Complexity | 316.0 |
| SMILES | C1=CC2=C(C=CC3=C2C=C(O3)[N+](=O)[O-])C=C1O |
| InChIKey | ILEWGACZMVZKTJ-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO-. Following Lipinski's Rule of Five, NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- is 86539-63-1.
The molecular formula of NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- is C12H7NO4.
The molecular weight of NAPHTHO(2,1-b)FURAN-7-OL, 2-NITRO- is 229.0375 g/mol.
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