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399-52-0

Name 5-Fluoroindole
CAS 399-52-0
EINECS(EC#) 206-917-4
Molecular Formula C8H6FN
MDL Number MFCD00005671
Molecular Weight 135.14
MOL File 399-52-0.mol
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Chemical Properties

Appearance off-white crystalline powder
Melting point  45-48 °C (lit.)
Boiling point  120 °C / 1mmHg
density  1.1203 (estimate)
Fp  >230 °F
storage temp.  2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Crystalline Powder
pka 16.16±0.30(Predicted)
color  Off-white
BRN  112350
InChI InChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
InChIKey ODFFPRGJZRXNHZ-UHFFFAOYSA-N
SMILES N1C2=C(C=C(F)C=C2)C=C1
CAS DataBase Reference 399-52-0(CAS DataBase Reference)
NIST Chemistry Reference 1H-indole, 5-fluoro-(399-52-0)

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 .
WGK Germany  3
F  10
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29339900

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