112888-43-4

Name 6-Bromomethyl-3,4-dihydro-2-methyl-quinazolin-4-one
CAS 112888-43-4
Molecular Formula C10H9BrN2O
MDL Number MFCD06200810
Molecular Weight 253.1
MOL File 112888-43-4.mol

Chemical Properties

Melting point  >330 °C(Solv: chloroform (67-66-3))
Boiling point  399.4±44.0 °C(Predicted)
density  1.63±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
pka 2.21±0.20(Predicted)
Usage Raltitrexed intermediate
InChI InChI=1S/C10H9BrN2O/c1-6-12-9-3-2-7(5-11)4-8(9)10(14)13-6/h2-4H,5H2,1H3,(H,12,13,14)
InChIKey YAHALGNQKDVJLJ-UHFFFAOYSA-N
SMILES N1C2=C(C=C(CBr)C=C2)C(=O)NC=1C
CAS DataBase Reference 112888-43-4(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H312-H315-H319
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338

Hazard Information

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