![4-(1-Benzotriazolyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine structure](/static/products/3016/301655-08-3.webp)
4-(1-Benzotriazolyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
4-(benzotriazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
Also Known As: BAS 00126560|4-(1-benzotriazolyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine|4-(benzotriazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine|4-(benzotriazol-1-yl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine|4-Benzotriazol-1-yl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine|4-benzotriazolyl-5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]pyrimidine
CAS: 301655-08-3
| Molecular Formula | C16H13N5S |
|---|---|
| Molecular Weight | 307.08917 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.08917 |
| Monoisotopic Mass | 307.08917 |
| Heavy Atoms | 22 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 301655-08-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=CN=C3S2)N4C5=CC=CC=C5N=N4 |
| InChIKey | MHKFSUVKILPXAD-UHFFFAOYSA-N |
Product Overview
4-(1-Benzotriazolyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine (CAS 301655-08-3), with molecular formula C16H13N5S and molecular weight 307.08917 g/mol. IUPAC: 4-(benzotriazol-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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