86688-96-2

Name (PYRROL-3-YL)-ACETIC ACID
CAS 86688-96-2
Molecular Formula C6H7NO2
MDL Number MFCD09800534
Molecular Weight 125.13
MOL File 86688-96-2.mol
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Chemical Properties

Melting point  90-91 °C
Boiling point  312.3±17.0 °C(Predicted)
density  1.314±0.06 g/cm3(Predicted)
storage temp.  2-8°C
form  solid
pka 4.42±0.10(Predicted)
InChI 1S/C6H7NO2/c8-6(9)3-5-1-2-7-4-5/h1-2,4,7H,3H2,(H,8,9)
InChIKey LAZKLUQBPMKCFN-UHFFFAOYSA-N
SMILES OC(CC1=CNC=C1)=O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P261-P280-P305+P351+P338
WGK Germany  WGK 3
HS Code  2933998090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Spectrum Detail

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