186689-07-6

Name 2-(N-(7-NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)AMINO)-2-DEOXYGLUCOSE
CAS 186689-07-6
Molecular Formula C12H14N4O8
MDL Number MFCD03454140
Molecular Weight 342.26
MOL File 186689-07-6.mol

Chemical Properties

Melting point  137 - 140°C
Boiling point  740.0±70.0 °C(Predicted)
density  1.750±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,Store in freezer, under -20°C
solubility  Soluble in DMSO (up to 10 mg/ml).
form  solid
pka 12.96±0.20(Predicted)
color  Dark yellow to orange/red
biological source synthetic
BRN  7603370
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20° for up to 1 month.
InChI InChI=1S/C12H14N4O8/c17-3-6(11(20)12(21)8(19)4-18)13-5-1-2-7(16(22)23)10-9(5)14-24-15-10/h1-3,6,8,11-13,18-21H,4H2/t6-,8+,11+,12+/m0/s1
InChIKey QUTFFEUUGHUPQC-ILWYWAAHSA-N
SMILES O=C[C@H](NC1C2C(C([N+]([O-])=O)=CC=1)=NON=2)[C@H]([C@@H]([C@@H](CO)O)O)O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P271-P280
WGK Germany  3
HS Code  2934999090

Hazard Information

Supplier