6-Hydroxymelatonin

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Catalog Number
ACM2208415
Product Name
6-Hydroxymelatonin
Structure
Structure
CAS
2208-41-5
Category
Heterocyclic Organic Compound
Synonyms
Melatonin, 6-hydroxy
IUPAC Name
N-[2-(6-Hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide
Molecular Weight
248.28
Molecular Formula
C13H16N2O3
Canonical SMILES
CC(=O)NCCC1=CNC2=CC(=C(C=C21)OC)O
InChI
InChI=1S/C13H16N2O3/c1-8(16)14-4-3-9-7-15-11-6-12(17)13(18-2)5-10(9)11/h5-7,15,17H,3-4H2,1-2H3,(H,14,16)
InChI Key
OMYMRCXOJJZYKE-UHFFFAOYSA-N
Boiling Point
564.7±50.0 °C
Melting Point
172-175 °C
Flash Point
295.3 °C
Density
1.266±0.06 g/cm³
Appearance
Solid
Storage
Refrigerator
Complexity
298
Exact Mass
248.11609238
Monoisotopic Mass
248.11609238
pKa
10.12±0.40(Predicted)
Refractive Index
1.627
Topological Polar Surface Area
74.4 Ų
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