1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-
TL;DR: 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- (CAS 94120-22-6) is a chemical compound with molecular formula C9H10N4O4 and molecular weight 238.0702 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5-methoxy-6-nitrobenzotriazol-1-yl)ethanol
Also Known As: 5-Methoxy-6-nitro-1H-benzotriazole-1-ethanol, 1H-BENZOTRIAZOLE-1-ETHANOL, 5-METHOXY-6-NITRO-, 2-(5-methoxy-6-nitrobenzotriazol-1-yl)ethanol, 2-(5-Methoxy-6-nitro-1H-benzo[d][1,2,3]triazol-1-yl)ethanol, 2-(5-Methoxy-6-nitro-1H-1,2,3-benzotriazol-1-yl)ethan-1-ol
Technical Specifications
| Molecular Formula | C9H10N4O4 |
| Molecular Weight | 238.0702 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0702 Da |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
| SMILES | COC1=C(C=C2C(=C1)N=NN2CCO)[N+](=O)[O-] |
| InChIKey | RZOSCHRJNRQVNG-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-
Property Insights of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-. Following Lipinski's Rule of Five, 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-?
The CAS number of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- is 94120-22-6.
What is the molecular formula of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-?
The molecular formula of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- is C9H10N4O4.
What is the molecular weight of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-?
The molecular weight of 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- is 238.0702 g/mol.
Where can I buy 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-?
You can request a quote for 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro-?
Yes, CoreyChem provides custom synthesis services for 1H-Benzotriazole-1-ethanol, 5-methoxy-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.