287118-97-2

Name 2-(ACETYLOXY)-4-[(NITROOXY)METHYL]PHENYL ESTER, BENZOIC ACID
CAS 287118-97-2
Molecular Formula C16H13NO7
MDL Number MFCD08062164
Molecular Weight 331.28
MOL File 287118-97-2.mol
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Chemical Properties

Melting point  83-86°C
Boiling point  495.7±40.0 °C(Predicted)
density  1.347±0.06 g/cm3(Predicted)
storage temp.  -20°C
solubility  DMSO: soluble15mg/mL (clear solution)
form  powder
color  white to beige
InChI 1S/C16H13NO7/c1-11(18)23-15-5-3-2-4-14(15)16(19)24-13-8-6-12(7-9-13)10-22-17(20)21/h2-9H,10H2,1H3
InChIKey CTHNKWFUDCMLIQ-UHFFFAOYSA-N
SMILES CC(=O)Oc1ccccc1C(=O)Oc2ccc(CO[N+]([O-])=O)cc2

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
RIDADR  UN 3077 9 / PGIII
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Acute 1
Eye Dam. 1
Skin Sens. 1

Hazard Information

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