Chem
J-GLOBAL ID:201207048878920730
Nikkaji number:J3.043.108A
1,3,7-Trimethyl-8-difluoromethyl-7H-purine-2,6(1H,3H)-dione
1,3,7-トリメチル-8-ジフルオロメチル-7H-プリン-2,6(1H,3H)-ジオン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C9 H10 F2 N4 O2
Molecular formula furigana:
C9-H10-F2-N4-O2
Molecular weight:
244.202
InChI:
InChI=1S/C9H10F2N4O2/c1-13-4-6(12-7(13)5(10)11)14(2)9(17)15(3)8(4)16/h5H,1-3H3
InChI key:
CHTVRSPUJYGRHE-UHFFFAOYSA-N
SMILES:
Cn1c(nc2n(C)c(=O)n(C)c(=O)c12)C(F)F
Systematic name (4):
8-(ジフルオロメチル)-1,2,3,6-テトラヒドロ-1,3,7-トリメチル-7H-プリン-2,6-ジオン
1,3,7-トリメチル-8-ジフルオロメチル-7H-プリン-2,6(1H,3H)-ジオン
8-(ジフルオロメチル)-1,3,7-トリメチル-2,3,6,7-テトラヒドロ-1H-プリン-2,6-ジオン
8-(difluoromethyl)-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Other name (2):
8-(Difluoromethyl)-1,2,3,6-tetrahydro-1,3,7-trimethyl-7H-purine-2,6-dione
1,3,7-Trimethyl-8-difluoromethyl-7H-purine-2,6(1H,3H)-dione
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