(5-Nitrothiophen-2-yl)methanol
TL;DR: (5-Nitrothiophen-2-yl)methanol (CAS 1017232-88-0) is a chemical compound with molecular formula C5H5NO3S and molecular weight 158.99901 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-nitrothiophen-2-yl)methanol
Also Known As: (5-nitrothiophen-2-yl)methanol, 2-(Hydroxymethyl)-5-nitrothiophene, 2-Thiophenemethanol, 5-nitro-, 5-nitrothien-2-ylmethanol, 2-thiophenemethanol,5-nitro
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H5NO3S |
| Molecular Weight | 158.99901 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 94.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.99901 Da |
| Heavy Atoms | 10 |
| Complexity | 135.0 |
| SMILES | C1=C(SC(=C1)[N+](=O)[O-])CO |
| InChIKey | QYNOWSBTIMNUDS-UHFFFAOYSA-N |
Chemical Property Profile of (5-Nitrothiophen-2-yl)methanol
Property Insights of (5-Nitrothiophen-2-yl)methanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Nitrothiophen-2-yl)methanol. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Nitrothiophen-2-yl)methanol. Following Lipinski's Rule of Five, (5-Nitrothiophen-2-yl)methanol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (5-Nitrothiophen-2-yl)methanol?
The CAS number of (5-Nitrothiophen-2-yl)methanol is 1017232-88-0.
What is the molecular formula of (5-Nitrothiophen-2-yl)methanol?
The molecular formula of (5-Nitrothiophen-2-yl)methanol is C5H5NO3S.
What is the molecular weight of (5-Nitrothiophen-2-yl)methanol?
The molecular weight of (5-Nitrothiophen-2-yl)methanol is 158.99901 g/mol.
Where can I buy (5-Nitrothiophen-2-yl)methanol?
You can request a quote for (5-Nitrothiophen-2-yl)methanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-Nitrothiophen-2-yl)methanol?
Yes, CoreyChem provides custom synthesis services for (5-Nitrothiophen-2-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.