1,3,7-trimethyl-8-(trichloromethyl)purine-2,6-dione
Names
[ CAS No. ]:
94339-63-6
[ Name ]:
1,3,7-trimethyl-8-(trichloromethyl)purine-2,6-dione
[Synonym ]:
8-trichloromethylcaffeine
1,3,7-Trimethyl-8-trichlormethyl-3,7-dihydro-purin-2,6-dion
TWNSCSKRVKTOJQ-UHFFFAOYSA
1,3,7-trimethyl-8-trichloromethyl-3,7-dihydro-purine-2,6-dione
InChI=1/C9H9Cl3N4O2/c1-14-4-5(13-7(14)9(10,11)12)15(2)8(18)16(3)6(4)17/h1-3H3
1H-Purine-2,6-dione,3,7-dihydro-1,3,7-trimethyl-8-(trichloromethyl)
Chemical & Physical Properties
[ Molecular Formula ]:
C9H9Cl3N4O2
[ Molecular Weight ]:
311.55200
[ Exact Mass ]:
309.97900
[ PSA ]:
61.82000
[ LogP ]:
0.79740