18704-67-1

Name 4-CHLORO-2-(1H-PYRAZOL-3-YL)PHENOL
CAS 18704-67-1
EINECS(EC#) 242-516-0
Molecular Formula C9H7ClN2O
MDL Number MFCD00209566
Molecular Weight 194.62
MOL File 18704-67-1.mol
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Chemical Properties

Appearance White crystalline powder
Melting point  155-158 °C(lit.)
Boiling point  411.2±30.0 °C(Predicted)
density  1.424±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  powder to crystal
pka 8.48±0.43(Predicted)
color  White to Orange to Green
InChI 1S/C9H7ClN2O/c10-6-1-2-9(13)7(5-6)8-3-4-11-12-8/h1-5,13H,(H,11,12)
InChIKey DMGLUMYOLOAXJY-UHFFFAOYSA-N
SMILES Oc1ccc(Cl)cc1-c2cc[nH]n2
CAS DataBase Reference 18704-67-1(CAS DataBase Reference)

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
HS Code  29331990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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