18300-89-5

Name ETHYL 2-CYANO-3-PHENYL-2-BUTENOATE
CAS 18300-89-5
Molecular Formula C13H13NO2
MDL Number MFCD00182513
Molecular Weight 215.25
MOL File 18300-89-5.mol
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Chemical Properties

Melting point  46-47℃
Boiling point  136-137 °C2 mm Hg(lit.)
density  1.092 g/mL at 25 °C(lit.)
refractive index  n20/D 1.548(lit.)
Fp  >230 °F
InChI 1S/C13H13NO2/c1-3-16-13(15)12(9-14)10(2)11-7-5-4-6-8-11/h4-8H,3H2,1-2H3
InChIKey AJDOTEWSLNGINB-UHFFFAOYSA-N
SMILES CCOC(=O)C(C#N)=C(C)c1ccccc1

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
WGK Germany  3
RTECS  GQ3360000
HazardClass  IRRITANT
HS Code  2926907090
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Toxicity
mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#09334,

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