Identification Chemical Properties Safety Data Hazard Information Supplier Related Products

59468-44-9

Name 8-chloro-6-(o-fluorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid
CAS 59468-44-9
EINECS(EC#) 261-777-1
Molecular Formula C19H13ClFN3O2
MDL Number MFCD18974963
Molecular Weight 369.78
MOL File 59468-44-9.mol
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Chemical Properties

Boiling point  590.7±60.0 °C(Predicted)
density  1.47±0.1 g/cm3(Predicted)
storage temp.  2-8°C
form  neat
pka 6.11±0.40(Predicted)
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C19H13ClFN3O2/c1-10-23-18(19(25)26)16-9-22-17(12-4-2-3-5-14(12)21)13-8-11(20)6-7-15(13)24(10)16/h2-8H,9H2,1H3,(H,25,26)
InChIKey WZNYKINYEPCGAZ-UHFFFAOYSA-N
SMILES N12C(C)=NC(C(O)=O)=C1CN=C(C1=CC=CC=C1F)C1=CC(Cl)=CC=C12

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

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