116764-15-9

Name AVENANTHRAMIDEC
CAS 116764-15-9
Molecular Formula C16H13NO6
MDL Number MFCD23380831
Molecular Weight 315.28
MOL File 116764-15-9.mol
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Chemical Properties

Melting point  248-250°C (dec.)
Boiling point  702.3±60.0 °C(Predicted)
density  1.582±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Methanol (Slightly, Heated)
form  neat
pka 3.37±0.36(Predicted)
color  Pale Yellow to Light Yellow
BRN  3624543
Cosmetics Ingredients Functions ANTIOXIDANT
HAIR CONDITIONING
SKIN PROTECTING
InChI 1S/C16H13NO6/c18-10-3-4-12(11(8-10)16(22)23)17-15(21)6-2-9-1-5-13(19)14(20)7-9/h1-8,18-20H,(H,17,21)(H,22,23)/b6-2+
InChIKey IDUUXROOZBOOPH-QHHAFSJGSA-N
SMILES OC1=CC=C(NC(/C=C/C2=CC(O)=C(O)C=C2)=O)C(C(O)=O)=C1

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Spectrum Detail

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