78338-22-4

Name CI 52000
CAS 78338-22-4
EINECS(EC#) 676-854-9
Molecular Formula C14H13N3O2S
MDL Number MFCD00081194
Molecular Weight 287.34
MOL File 78338-22-4.mol
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Chemical Properties

Appearance dark green powder or needle-like crystals
Melting point  >200℃
storage temp.  room temp
solubility  Soluble in water, ethanol
Colour Index  52000
form  Crystals or Crystalline Powder
pka 2.5, 11.3(at 25℃)
color  Dark green
Odor Stench odour
PH Range ~ 6.8
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Water Solubility  Soluble in water (~2.5 mg/ml at 25°C), and HOAc: H2O (1:1) (1 mg/ml). Insoluble in ethanol.
λmax 598 nm
BRN  4345073
Biological Applications Biosensors; diagnosis of diabetes; detecting ascorbic acid,uric acid,glucose,glomerular deposits
InChI 1S/C12H10N3S.C2H4O2/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;1-2(3)4/h1-6H,13-14H2;1H3,(H,3,4)/q+1;/p-1
InChIKey OWXBIRAFHWASMS-UHFFFAOYSA-M
SMILES CC([O-])=O.Nc1ccc2nc3ccc(N)cc3[s+]c2c1
CAS DataBase Reference 78338-22-4(CAS DataBase Reference)
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Safety Data

Hazard Codes  Xn
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  2811
WGK Germany  3
RTECS  SN5425000
HS Code  29309090
Storage Class 13 - Non Combustible Solids

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