AC1LJ3C2 structure

AC1LJ3C2

10-(3-chloro-4-methylphenyl)-4-ethyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene

Also Known As: 7-(3-chloro-4-methylphenyl)-2-ethyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine

CAS: 846589-34-2
Molecular Formula C15H13ClN6
Molecular Weight 312.08902 g/mol
LogP 2.98742
Topological Polar Surface Area 60.9 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 312.08902
Monoisotopic Mass 312.08902
Heavy Atoms 22
Complexity 1000.03064

Chemical Identifiers

CAS Number 846589-34-2
SMILES CCC1=NN2C=NC3=C(C2=N1)C=NN3C4=CC(=C(C=C4)C)Cl

Product Overview

AC1LJ3C2 (CAS 846589-34-2), with molecular formula C15H13ClN6 and molecular weight 312.08902 g/mol. IUPAC: 10-(3-chloro-4-methylphenyl)-4-ethyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene.

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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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