≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Product Application:
Reactant for:
Photodecomposition reactions
Tele nucleophilic aromatic substitutions
Para-formylation of nitroarenes via nucleophilic substitution
| Pubchem Sid | 504762699 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504762699 |
| Canonical Smiles | C1=CC=C2C(=C1)N=NN2C(N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5 |
| IUPAC Name | 1-[bis(benzotriazol-1-yl)methyl]benzotriazole |
| InChIKey | VENLCXAGJRTBFL-UHFFFAOYSA-N |
| INCHI | 1S/C19H13N9/c1-4-10-16-13(7-1)20-23-26(16)19(27-17-11-5-2-8-14(17)21-24-27)28-18-12-6-3-9-15(18)22-25-28/h1-12,19H |
| Isomeric SMILES | C1=CC=C2C(=C1)N=NN2C(N3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5 |
| WGK Germany | 3 |
| PubChem CID | 3733734 |
| Molecular Weight | 367.38 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Benzotriazoles |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzotriazoles |
| Alternative Parents | Benzenoids Triazoles Heteroaromatic compounds Ortho amides Azacyclic compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzotriazole - Benzenoid - Heteroaromatic compound - 1,2,3-triazole - Triazole - Azole - Ortho amide - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzotriazoles. These are organic compounds containing a benzene fused to a triazole ring (a five-membered ring with two carbon atoms and three nitrogen atoms). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 G23051052 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| G2305974 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| G2305975 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| G2305976 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| G2305978 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| G2305982 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| J2522071 | Certificate of Analysis | Jun 14, 2023 | T161621 |
| Melt Point(°C) | 191°C(lit.) |
|---|---|
| Molecular Weight | 367.400 g/mol |
| XLogP3 | 3.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 367.129 Da |
| Monoisotopic Mass | 367.129 Da |
| Topological Polar Surface Area | 92.100 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 485.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
