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D-Luciferin Structure

D-Luciferin

Chemical Properties

Melting point 200-204 °C
alpha  D22 -36° (c = 1.2 in DMF)
Boiling point 587.6±60.0 °C(Predicted)
Density  1.4916 (rough estimate)
refractive index  1.5650 (estimate)
storage temp.  -20°C
solubility  DMF:30.0(Max Conc. mg/mL);107.02(Max Conc. mM)
DMSO:35.33(Max Conc. mg/mL);126.05(Max Conc. mM)
pka 8.31±0.40(Predicted)
form  Powder
color  Off-white to light yellow
λmax 360nm(H2O)(lit.)
Merck  14,4086
BRN  30484
InChI InChI=1S/C11H8N2O3S2/c14-5-1-2-6-8(3-5)18-10(12-6)9-13-7(4-17-9)11(15)16/h1-3,7,14H,4H2,(H,15,16)/t7-/m1/s1
InChIKey BJGNCJDXODQBOB-SSDOTTSWSA-N
SMILES S1C[C@H](C(O)=O)N=C1C1=NC2=CC=C(O)C=C2S1
FDA UNII 5TBB02N29K

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P271-P280
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36/37/39-24/25
WGK Germany  3
8-10
HS Code  29342000

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D-Luciferin Chemical Properties,Usage,Production

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D-Luciferin Spectrum