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H-D-CIT-OH Structure

H-D-CIT-OH

Chemical Properties

Melting point 220-221°C
Boiling point 386.7±42.0 °C(Predicted)
Density  1.289±0.06 g/cm3(Predicted)
storage temp.  -20°C
pka 2.51±0.24(Predicted)
optical activity [α]20/D 20.5±2.0°, c = 2% in 1 M HCl
BRN  1725415
InChI InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m1/s1
InChIKey RHGKLRLOHDJJDR-SCSAIBSYSA-N
SMILES C(O)(=O)[C@@H](CCCNC(N)=O)N
CAS DataBase Reference 13594-51-9(CAS DataBase Reference)
FDA UNII KNS2VUH6P2

Safety

WGK Germany  3

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H-D-CIT-OH Chemical Properties,Usage,Production

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