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201730-11-2

Name (S)-3,4-DCPG
CAS 201730-11-2
Molecular Formula C10H9NO6
MDL Number MFCD03453633
Molecular Weight 239.18
MOL File 201730-11-2.mol
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Chemical Properties

Boiling point  531.0±50.0 °C(Predicted)
density  1.634±0.06 g/cm3(Predicted)
storage temp.  Desiccate at RT
solubility  DMF: 25 mg/ml; DMSO: 20 mg/ml; Ethanol: 33 mg/ml; PBS (pH 7.2): 10 mg/ml
form  Powder
pka 1.59±0.10(Predicted)
Water Solubility  Soluble to 100 mM in water
InChI InChI=1S/C10H9NO6/c11-7(10(16)17)4-1-2-5(8(12)13)6(3-4)9(14)15/h1-3,7H,11H2,(H,12,13)(H,14,15)(H,16,17)/t7-/m0/s1
InChIKey IJVMOGKBEVRBPP-ZETCQYMHSA-N
SMILES C1(C(O)=O)=CC=C([C@H](N)C(O)=O)C=C1C(O)=O

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H312-H332
Precautionary statements  P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501

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