870703-72-3

Name 4-(BOC-PIPERAZIN-1-YL)-3-NITROBENZOIC A&
CAS 870703-72-3
Molecular Formula C16H21N3O6
MDL Number MFCD07369744
Molecular Weight 351.35
MOL File 870703-72-3.mol
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Chemical Properties

Melting point  199-203 °C (dec.)(lit.)
Boiling point  529.2±50.0 °C(Predicted)
density  1.329±0.06 g/cm3(Predicted)
form  solid
pka 4.48±0.10(Predicted)
InChI 1S/C16H21N3O6/c1-16(2,3)25-15(22)18-8-6-17(7-9-18)12-5-4-11(14(20)21)10-13(12)19(23)24/h4-5,10H,6-9H2,1-3H3,(H,20,21)
InChIKey CYGRJUZYSXUAMM-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(cc2[N+]([O-])=O)C(O)=O

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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