1-Naphthol, 2,4,5-trinitro-
TL;DR: 1-Naphthol, 2,4,5-trinitro- (CAS 63978-89-2) is a chemical compound with molecular formula C10H5N3O7 and molecular weight 279.01276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,5-trinitronaphthalen-1-ol
Also Known As: Naphthopicric acid, 2,4,5-Trinitro-1-naphthol, 2,4,5-Trinitro-1-naftol, 2,4,5-trinitronaphthalen-1-ol, 1-NAPHTHOL, 2,4,5-TRINITRO-
Technical Specifications
| Molecular Formula | C10H5N3O7 |
| Molecular Weight | 279.01276 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 158.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 279.01276 Da |
| Heavy Atoms | 20 |
| Complexity | 426.0 |
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | LDPULBMOCMQAOT-UHFFFAOYSA-N |
Chemical Property Profile of 1-Naphthol, 2,4,5-trinitro-
Property Insights of 1-Naphthol, 2,4,5-trinitro-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Naphthol, 2,4,5-trinitro-. The TPSA of 158.0 Ų indicates high polarity, suggesting 1-Naphthol, 2,4,5-trinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Naphthol, 2,4,5-trinitro- has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Naphthol, 2,4,5-trinitro-?
The CAS number of 1-Naphthol, 2,4,5-trinitro- is 63978-89-2.
What is the molecular formula of 1-Naphthol, 2,4,5-trinitro-?
The molecular formula of 1-Naphthol, 2,4,5-trinitro- is C10H5N3O7.
What is the molecular weight of 1-Naphthol, 2,4,5-trinitro-?
The molecular weight of 1-Naphthol, 2,4,5-trinitro- is 279.01276 g/mol.
Where can I buy 1-Naphthol, 2,4,5-trinitro-?
You can request a quote for 1-Naphthol, 2,4,5-trinitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Naphthol, 2,4,5-trinitro-?
Yes, CoreyChem provides custom synthesis services for 1-Naphthol, 2,4,5-trinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.