1222800-79-4

Name ML234
CAS 1222800-79-4
Molecular Formula C21H23N3O2
MDL Number MFCD28053518
Molecular Weight 349.43
MOL File 1222800-79-4.mol
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Chemical Properties

Melting point  >187oC (dec.)
Boiling point  590.1±50.0 °C(Predicted)
density  1.188±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: soluble10mg/mL, clear
form  powder
pka 4.71±0.40(Predicted)
color  white to light brown
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20° for up to 1 month.
InChI 1S/C21H23N3O2/c1-24(2)12-4-11-23-21(26)16-8-6-15(7-9-16)18-13-17-5-3-10-22-20(17)19(25)14-18/h3,5-10,13-14,25H,4,11-12H2,1-2H3,(H,23,26)
InChIKey QDBVSOZTVKXUES-UHFFFAOYSA-N
SMILES CN(C)CCCNC(C1=CC=C(C2=CC(O)=C(N=CC=C3)C3=C2)C=C1)=O

Safety Data

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

Hazard Information

Spectrum Detail

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