1-ethyl-1H-1,3-benzodiazole
TL;DR: 1-ethyl-1H-1,3-benzodiazole (CAS 7099-88-9) is a chemical compound with molecular formula C9H10N2 and molecular weight 146.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylbenzimidazole
Also Known As: N-Ethylbenzimidazole, 1-Ethyl-1H-benzimidazole, 1-ethylbenzimidazole, null, ethylbenzimidazole
| Molecular Formula | C9H10N2 |
|---|---|
| Molecular Weight | 146.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.0844 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 7099-88-9 |
|---|---|
| SMILES | CCN1C=NC2=CC=CC=C21 |
| InChIKey | WVNMLOGVAVGQIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-ethyl-1H-1,3-benzodiazole (CAS 7099-88-9), with molecular formula C9H10N2 and molecular weight 146.08 g/mol. IUPAC: 1-ethylbenzimidazole.
Chemical Property Profile of 1-ethyl-1H-1,3-benzodiazole
Property Insights of 1-ethyl-1H-1,3-benzodiazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-ethyl-1H-1,3-benzodiazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-ethyl-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-ethyl-1H-1,3-benzodiazole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-ethyl-1H-1,3-benzodiazole?
The CAS number of 1-ethyl-1H-1,3-benzodiazole is 7099-88-9.
What is the molecular formula of 1-ethyl-1H-1,3-benzodiazole?
The molecular formula of 1-ethyl-1H-1,3-benzodiazole is C9H10N2.
What is the molecular weight of 1-ethyl-1H-1,3-benzodiazole?
The molecular weight of 1-ethyl-1H-1,3-benzodiazole is 146.08 g/mol.
Where can I buy 1-ethyl-1H-1,3-benzodiazole?
You can request a quote for 1-ethyl-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-ethyl-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-ethyl-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.