Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722244
Compound Identification
Common NameTucatinib,2TBDMS,isomer#1
Structure
Average Molecular Weight708.3752
SMILESCC1=CC(N(C2=NC=NC3=CC=C(N(C4=NC(C)(C)CO4)[Si](C)(C)C(C)(C)C)C=C23)[Si](C)(C)C(C)(C)C)=CC=C1OC1=CC2=NC=NN2C=C1
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4222.727
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices