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HomeProduct name list2-(Acetylamino)-3-phenyl-2-propenoic acid

2-(Acetylamino)-3-phenyl-2-propenoic acid

Synonym(s):N-Acetyldehydrophenylalanine

  • CAS NO.:5469-45-4
  • Empirical Formula: C11H11NO3
  • Molecular Weight: 205.21
  • MDL number: MFCD00188416
  • EINECS: 226-795-6
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-06-08 17:06:37
2-(Acetylamino)-3-phenyl-2-propenoic acid Structural

What is 2-(Acetylamino)-3-phenyl-2-propenoic acid?

Chemical properties

White Solid

The Uses of 2-(Acetylamino)-3-phenyl-2-propenoic acid

A protein kinase C inhibitor

The Uses of 2-(Acetylamino)-3-phenyl-2-propenoic acid

test substance for asymmetric hydrogenations

Synthesis Reference(s)

Tetrahedron Letters, 24, p. 4603, 1983 DOI: 10.1016/S0040-4039(00)85967-5
Synthesis, p. 418, 1984 DOI: 10.1055/s-1984-30859

Purification Methods

It crystallises from H2O as the dihydrate, and on drying at 100o it forms the anhydrous compound which is hygroscopic. Alkaline hydrolysis yields NH3

Properties of 2-(Acetylamino)-3-phenyl-2-propenoic acid

Melting point: 188-190 °C(lit.)
Boiling point: 455.4±45.0 °C(Predicted)
Density  1.32 g/cm3
storage temp.  2-8°C
solubility  methanol: soluble100mg/mL, clear, yellow-green
form  Solid
pka 3.52±0.10(Predicted)
color  White
BRN  1912549
CAS DataBase Reference 5469-45-4(CAS DataBase Reference)
NIST Chemistry Reference «alpha»-Acetamidocinnamic acid(5469-45-4)

Safety information for 2-(Acetylamino)-3-phenyl-2-propenoic acid

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 2-(Acetylamino)-3-phenyl-2-propenoic acid

InChIKey XODAOBAZOQSFDS-JXMROGBWSA-N

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