1173018-69-3

Name 1-Methylxanthine-13C4,15N3
CAS 1173018-69-3
Molecular Formula C6H6N4O2
MDL Number MFCD11656099
Molecular Weight 173.2
MOL File 1173018-69-3.mol
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Chemical Properties

Melting point  ≥300 °C
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)/i3+1,4+1,5+1,6+1,8+1,9+1,10+1
InChIKey MVOYJPOZRLFTCP-UDDVCBLJSA-N
SMILES C[15N]1[13C](=O)[15NH][13c]2[15nH]cn[13c]2[13C]1=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

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