917392-54-2

Name 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester
CAS 917392-54-2
Molecular Formula C18H16N4O2
MDL Number MFCD16619370
Molecular Weight 320.35
MOL File 917392-54-2.mol
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Chemical Properties

Melting point  148 - 150°C
Boiling point  538.6±60.0 °C(Predicted)
density  1.258
storage temp.  Sealed in dry,2-8°C
solubility  Chloroform (Slightly), DMSO (Slightly)
form  Solid
pka 2.70±0.12(Predicted)
color  Pale Yellow to Light Beige
InChI InChI=1S/C18H16N4O2/c1-12-5-6-13(17(23)24-2)10-16(12)22-18-20-9-7-15(21-18)14-4-3-8-19-11-14/h3-11H,1-2H3,(H,20,21,22)
InChIKey BECBKQYLJDEVDN-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC=C(C)C(NC2=NC=CC(C3=CC=CN=C3)=N2)=C1

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P280-P301+P312-P304+P340
HS Code  2916399090

Hazard Information

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