1H-Benzotriazole, 6,6'-methylenebis-
TL;DR: 1H-Benzotriazole, 6,6'-methylenebis- (CAS 15805-10-4) is a chemical compound with molecular formula C13H10N6 and molecular weight 250.0967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2H-benzotriazol-5-ylmethyl)-2H-benzotriazole
Also Known As: Bis(1H-benzo[d][1,2,3]triazol-5-yl)methane, Methylenebisbenzotriazole, 1H-Benzotriazole, 5,5'-methylenebis-, 3-Chlorobenzotrifluoride, 5,5'-Methylenebis(1H-benzotriazole)
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H10N6 |
| Molecular Weight | 250.0967 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 83.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.0967 Da |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
| SMILES | C1=CC2=NNN=C2C=C1CC3=CC4=NNN=C4C=C3 |
| InChIKey | IWASLBFJTMJYHF-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Benzotriazole, 6,6'-methylenebis-
Property Insights of 1H-Benzotriazole, 6,6'-methylenebis-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzotriazole, 6,6'-methylenebis-. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzotriazole, 6,6'-methylenebis-. Following Lipinski's Rule of Five, 1H-Benzotriazole, 6,6'-methylenebis- 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 1H-Benzotriazole, 6,6'-methylenebis-?
The CAS number of 1H-Benzotriazole, 6,6'-methylenebis- is 15805-10-4.
What is the molecular formula of 1H-Benzotriazole, 6,6'-methylenebis-?
The molecular formula of 1H-Benzotriazole, 6,6'-methylenebis- is C13H10N6.
What is the molecular weight of 1H-Benzotriazole, 6,6'-methylenebis-?
The molecular weight of 1H-Benzotriazole, 6,6'-methylenebis- is 250.0967 g/mol.
Where can I buy 1H-Benzotriazole, 6,6'-methylenebis-?
You can request a quote for 1H-Benzotriazole, 6,6'-methylenebis- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Benzotriazole, 6,6'-methylenebis-?
Yes, CoreyChem provides custom synthesis services for 1H-Benzotriazole, 6,6'-methylenebis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.