(5-nitro-1H-1,3-benzodiazol-2-yl)methanol
TL;DR: (5-nitro-1H-1,3-benzodiazol-2-yl)methanol (CAS 102507-13-1) is a chemical compound with molecular formula C8H7N3O3 and molecular weight 193.04874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6-nitro-1H-benzimidazol-2-yl)methanol
Also Known As: (5-Nitro-1H-benzo[d]imidazol-2-yl)methanol, (5-nitro-1H-1,3-benzodiazol-2-yl)methanol, (5-nitro-1H-benzimidazol-2-yl)methanol, (6-nitro-1H-benzimidazol-2-yl)methanol, 5-Nitro-1H-benzimidazole-2-methanol
Technical Specifications
| Molecular Formula | C8H7N3O3 |
| Molecular Weight | 193.04874 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 94.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.04874 Da |
| Heavy Atoms | 14 |
| Complexity | 230.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)CO |
| InChIKey | ZJLPIDVKNQXTKN-UHFFFAOYSA-N |
Chemical Property Profile of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol
Property Insights of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-nitro-1H-1,3-benzodiazol-2-yl)methanol. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-nitro-1H-1,3-benzodiazol-2-yl)methanol. Following Lipinski's Rule of Five, (5-nitro-1H-1,3-benzodiazol-2-yl)methanol has 2 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-nitro-1H-1,3-benzodiazol-2-yl)methanol?
The CAS number of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol is 102507-13-1.
What is the molecular formula of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol?
The molecular formula of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol is C8H7N3O3.
What is the molecular weight of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol?
The molecular weight of (5-nitro-1H-1,3-benzodiazol-2-yl)methanol is 193.04874 g/mol.
Where can I buy (5-nitro-1H-1,3-benzodiazol-2-yl)methanol?
You can request a quote for (5-nitro-1H-1,3-benzodiazol-2-yl)methanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-nitro-1H-1,3-benzodiazol-2-yl)methanol?
Yes, CoreyChem provides custom synthesis services for (5-nitro-1H-1,3-benzodiazol-2-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.