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1204-06-4

Name 3-Indoleacrylic acid
CAS 1204-06-4
EINECS(EC#) 214-872-7
Molecular Formula C11H9NO2
MDL Number MFCD00005633
Molecular Weight 187.19
MOL File 1204-06-4.mol
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Chemical Properties

Appearance light yellow to yellow-beige crystalline powder
Melting point  185 °C (dec.)(lit.)
Boiling point  321.94°C (rough estimate)
density  1.1963 (rough estimate)
refractive index  1.4900 (estimate)
storage temp.  0-6°C
form  powder
pka 4.59±0.10(Predicted)
color  white to light yellow
Water Solubility  freely soluble
BRN  6317
InChI InChI=1S/C11H9NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-7,12H,(H,13,14)
InChIKey PLVPPLCLBIEYEA-UHFFFAOYSA-N
SMILES C(O)(=O)C=CC1C2=C(NC=1)C=CC=C2
CAS DataBase Reference 1204-06-4(CAS DataBase Reference)
EPA Substance Registry System 1204-06-4(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
RTECS  NL3680000
TSCA  TSCA listed
HazardClass  IRRITANT
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

Material Safety Data Sheet(MSDS)

Spectrum Detail

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