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36015-19-7

Name 2-CHLORO-5-NITROCINNAMIC ACID
CAS 36015-19-7
Molecular Formula C9H6ClNO4
MDL Number MFCD00063312
Molecular Weight 227.6
MOL File 36015-19-7.mol
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Chemical Properties

Appearance light beige crystalline powder
Melting point  218-222 °C
Boiling point  401.7±35.0 °C(Predicted)
density  1.529±0.06 g/cm3 (20 ºC 760 Torr)
refractive index  1.6000 (estimate)
form  powder to crystal
pka 3.97±0.10(Predicted)
color  White to Yellow to Green
BRN  1972431
InChI InChI=1S/C9H6ClNO4/c10-8-3-2-7(11(14)15)5-6(8)1-4-9(12)13/h1-5H,(H,12,13)
InChIKey IHTLKLSRRSWIGD-UHFFFAOYSA-N
SMILES C(O)(=O)C=CC1=CC([N+]([O-])=O)=CC=C1Cl
CAS DataBase Reference 36015-19-7(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  2921490090

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