| Identification | Back Directory | [Name]
1-Methylxanthine-13C,D3 | [CAS]
1202865-49-3 | [Synonyms]
1-Methylxanthine-13C,D3
1-(Methyl-!3C,d3)xanthine
1-METHYLXANTHINE (CHEMICAL PURITY 97%) (1-METHYL,6-13C2, 99%
1-Methylxanthine-(methyl-13C,d3) 98 atom % 13C, 98 atom % D, 97% (CP) | [Molecular Formula]
C6H6N4O2 | [MDL Number]
MFCD11656100 | [MOL File]
1202865-49-3.mol | [Molecular Weight]
170.15 |
| Chemical Properties | Back Directory | [Melting point ]
≥300°C | [density ]
1.540±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) | [storage temp. ]
-20°C | [form ]
powder | [InChI]
1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12)/i1+1D3 | [InChIKey]
MVOYJPOZRLFTCP-KQORAOOSSA-N | [SMILES]
[2H][13C]([2H])([2H])N1C(=O)Nc2nc[nH]c2C1=O |
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