115610-36-1

Name 2-[[(2E)-3-(4-Hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]benzoic acid
CAS 115610-36-1
Molecular Formula C16H13NO4
Molecular Weight 283.28
MOL File 115610-36-1.mol
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Chemical Properties

Melting point  220 °C(Solv: water (7732-18-5); acetone (67-64-1))
Boiling point  578.1±50.0 °C(Predicted)
density  1.400±0.06 g/cm3(Predicted)
form  solid
pka 3.47±0.36(Predicted)
InChI 1S/C16H13NO4/c18-12-8-5-11(6-9-12)7-10-15(19)17-14-4-2-1-3-13(14)16(20)21/h1-10,18H,(H,17,19)(H,20,21)/b10-7+
InChIKey INBHLTYBRKASIZ-JXMROGBWSA-N
SMILES N(c2c(cccc2)C(=O)O)C(=O)\C=C\c1ccc(cc1)O

Safety Data

WGK Germany  WGK 3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Eye Irrit. 2
Repr. 1B
Skin Irrit. 2
STOT SE 3

Hazard Information

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