55869-99-3

Name ANISODAMINE
CAS 55869-99-3
Molecular Formula C17H23NO4
MDL Number MFCD01732987
Molecular Weight 305.37
MOL File 55869-99-3.mol

Chemical Properties

Melting point  62-63 °C
Boiling point  474.6±45.0 °C(Predicted)
density  1.27
storage temp.  room temp
solubility  H2O: ≥5mg/mL
form  powder
pka 14.12±0.10(Predicted)
color  white to beige
Water Solubility  H2O: ≥5mg/mL
InChI 1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12-,13-,14+,15+,16-/m0/s1
InChIKey WTQYWNWRJNXDEG-RBZJEDDUSA-N
SMILES CN1[C@H]2C(O)C[C@@H]1C[C@H](OC(C(CO)C3=CC=CC=C3)=O)C2

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2

Hazard Information

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