911222-45-2

Name ly2603618 IC-83
CAS 911222-45-2
Molecular Formula C18H22BrN5O3
MDL Number MFCD18633253
Molecular Weight 436.32
MOL File 911222-45-2.mol
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Chemical Properties

Boiling point  503.1±50.0 °C(Predicted)
density  1.461
storage temp.  -20°C
solubility  Soluble in DMSO (up to 10 mg/ml)
form  solid
pka 12.06±0.70(Predicted)
color  Off-white
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months.
InChI 1S/C18H22BrN5O3/c1-11-5-16(27-10-13-8-20-3-4-26-13)15(6-14(11)19)23-18(25)24-17-9-21-12(2)7-22-17/h5-7,9,13,20H,3-4,8,10H2,1-2H3,(H2,22,23,24,25)/t13-/m0/s1
InChIKey SYYBDNPGDKKJDU-ZDUSSCGKSA-N
SMILES N(C1=CC(Br)=C(C)C=C1OC[C@H]1OCCNC1)C(NC1=NC=C(C)N=C1)=O

Safety Data

WGK Germany  WGK 3
HS Code  29349990
Storage Class 11 - Combustible Solids

Hazard Information

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