82419-52-1

Name OFLOXACIN RELATED COMPOUND A (25 MG) ((RS)-9-FLUORO-2,3-DIHYDRO-3-METHYL-7-OXO-10-(PIPERA-ZIN-1 -YL)-7H-PYRIDO[1,2,3-DE]-1,4-BENZOXAZINE-6-CARBOXYLIC ACID)
CAS 82419-52-1
Molecular Formula C17H19ClFN3O4
MDL Number MFCD00871868
Molecular Weight 347.34
MOL File 82419-52-1.mol

Chemical Properties

Appearance Pale Yellow Solid
Melting point  >2500C (dec.)
Boiling point  600.7±55.0 °C(Predicted)
density  1.51±0.1 g/cm3(Predicted)
storage temp.  -20?C Freezer
solubility  Aqueous Base (Slightly), DMSO (Slightly, Heated, Sonicated), Methanol (Slightly)
form  neat
pka 5.19±0.40(Predicted)
color  Pale Yellow
BRN  4890029
Major Application pharmaceutical (small molecule)
InChI 1S/C17H18FN3O4/c1-9-8-25-16-13-10(15(22)11(17(23)24)7-21(9)13)6-12(18)14(16)20-4-2-19-3-5-20/h6-7,9,19H,2-5,8H2,1H3,(H,23,24)
InChIKey WKRSSAPQZDHYRV-UHFFFAOYSA-N
SMILES FC1=C(N2CCNCC2)C(OCC3C)=C(N3C=C(C(O)=O)C4=O)C4=C1

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  WGK 3
HS Code  2934990002
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Supplier