Nitro-1-hydroxypyrene
TL;DR: Nitro-1-hydroxypyrene (CAS 113093-71-3) is a chemical compound with molecular formula C16H9NO3 and molecular weight 263.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitropyren-1-ol
Also Known As: Nitropyrenol, Nitro-1-hydroxypyrene, Pyrenol, nitro-, 2-nitropyren-1-ol, nitrohydroxypyrene
| Molecular Formula | C16H9NO3 |
|---|---|
| Molecular Weight | 263.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.05826 |
| Heavy Atoms | 20 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 113093-71-3 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4O)[N+](=O)[O-])C=C2 |
| InChIKey | UGEFUZCXSPVSPJ-UHFFFAOYSA-N |
Product Overview
Nitro-1-hydroxypyrene (CAS 113093-71-3), with molecular formula C16H9NO3 and molecular weight 263.06 g/mol. IUPAC: 2-nitropyren-1-ol.
Chemical Property Profile of Nitro-1-hydroxypyrene
Property Insights of Nitro-1-hydroxypyrene
The XLogP value of 5.1 indicates that Nitro-1-hydroxypyrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitro-1-hydroxypyrene. Following Lipinski's Rule of Five, Nitro-1-hydroxypyrene has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nitro-1-hydroxypyrene?
The CAS number of Nitro-1-hydroxypyrene is 113093-71-3.
What is the molecular formula of Nitro-1-hydroxypyrene?
The molecular formula of Nitro-1-hydroxypyrene is C16H9NO3.
What is the molecular weight of Nitro-1-hydroxypyrene?
The molecular weight of Nitro-1-hydroxypyrene is 263.06 g/mol.
Where can I buy Nitro-1-hydroxypyrene?
You can request a quote for Nitro-1-hydroxypyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitro-1-hydroxypyrene?
Yes, KEHONG BIO provides custom synthesis services for Nitro-1-hydroxypyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.