N-γ-Acetyl-N-2-formyl-5-methoxykynurenamine

About This Item

Molecular Formula	C₁₃H₁₆N₂O₄
CAS Number	52450-38-1

FC-0038826

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Properties

Chemical Identifiers

IUPAC Name	N-[3-(2-formamido-5-methoxyphenyl)-3-oxopropyl]acetamide
SMILES	CC(=O)NCCC(=O)C1=C(C=CC(=C1)OC)NC=O
InChI Key	JYWNYMJKURVPFH-UHFFFAOYSA-N
InChI	InChI=1S/C13H16N2O4/c1-9(17)14-6-5-13(18)11-7-10(19-2)3-4-12(11)15-8-16/h3-4,7-8H,5-6H2,1-2H3,(H,14,17)(H,15,16)

Physical Properties

Boiling Point	589.4±50.0 °C at 760 mmHg
Melting Point	138-140ºC
Flash Point	310.3±30.1 °C
Density	1.2±0.1 g/cm3

Safety Information

Hazard Class

Danger

Flash Point

310.3±30.1 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.