AC1LIFAA
4-(trichloromethyl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: 2-(trichloromethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine|2-(trichloromethyl)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
CAS: 836624-53-4
| Molecular Formula | C12H9Cl3N4S |
|---|---|
| Molecular Weight | 345.96136 g/mol |
| LogP | 4.0445 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 345.96136 |
| Monoisotopic Mass | 345.96136 |
| Heavy Atoms | 20 |
| Complexity | 817.4253 |
Chemical Identifiers
| CAS Number | 836624-53-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN4C3=NC(=N4)C(Cl)(Cl)Cl |
Product Overview
AC1LIFAA (CAS 836624-53-4), with molecular formula C12H9Cl3N4S and molecular weight 345.96136 g/mol. IUPAC: 4-(trichloromethyl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
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.
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