Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01722213
Compound Identification
Common NameRipretinib,2TBDMS,isomer#3
Structure
Average Molecular Weight737.2592
SMILESCCN1C(=O)C(C2=CC(N(C(=O)N(C3=CC=CC=C3)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=C(F)C=C2Br)=CC2=CN=C(NC)C=C21
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index4901.6978
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices