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50890-83-0

Name 1-Methylindazole-3-carboxylic acid
CAS 50890-83-0
EINECS(EC#) 626-233-3
Molecular Formula C9H8N2O2
MDL Number MFCD00272569
Molecular Weight 176.17
MOL File 50890-83-0.mol

Chemical Properties

Melting point  213 °C
Boiling point  383.7±15.0 °C(Predicted)
density  1.35±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 3.14±0.10(Predicted)
color  White to Off White
Water Solubility  Insoluble in water. Soluble in DMSO and Methanol.
Detection Methods T,NMR
InChI InChI=1S/C9H8N2O2/c1-11-7-5-3-2-4-6(7)8(10-11)9(12)13/h2-5H,1H3,(H,12,13)
InChIKey OVVDFORZEGKEJM-UHFFFAOYSA-N
SMILES N1(C)C2=C(C=CC=C2)C(C(O)=O)=N1
CAS DataBase Reference 50890-83-0(CAS DataBase Reference)

Safety Data

Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
R36:Irritating to the eyes.
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S22:Do not breathe dust .
WGK Germany  3
Hazard Note  Harmful
HazardClass  IRRITANT
HS Code  29339900

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