131666-45-0

Name 4H-Imidazo[1,5-a][1,4]benzodiazepine-3-carboxylicacid, 5,6-dihydro-8-hydroxy-5-methyl-6-oxo-, ethyl ester
CAS 131666-45-0
Molecular Formula C15H15N3O4
Molecular Weight 301.3
MOL File 131666-45-0.mol
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Chemical Properties

Boiling point  588.6±50.0 °C(Predicted)
density  1.42±0.1 g/cm3(Predicted)
storage temp.  2-8°C
form  neat
pka 8.54±0.20(Predicted)
Major Application pharmaceutical (small molecule)
InChI 1S/C15H15N3O4/c1-3-22-15(21)13-12-7-17(2)14(20)10-6-9(19)4-5-11(10)18(12)8-16-13/h4-6,8,19H,3,7H2,1-2H3
InChIKey PCCARNSSXAGDHQ-UHFFFAOYSA-N
SMILES [n]21c(c(nc2)C(=O)OCC)CN(C(=O)c3c1ccc(c3)O)C

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

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