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ITK inhibitor 2
[CAS# 1309784-09-5]

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Identification
Name ITK inhibitor 2
Synonyms (2S)-N-[2-(6,6-dimethyl-1,4,5,7-tetrahydroindazol-3-yl)-1H-indol-6-yl]-N-methyl-2-morpholin-4-ylpropanamide
Molecular Structure CAS # 1309784-09-5, ITK inhibitor 2, (2S)-N-[2-(6,6-dimethyl-1,4,5,7-tetrahydroindazol-3-yl)-1H-indol-6-yl]-N-methyl-2-morpholin-4-ylpropanamide
Molecular Formula C25H33N5O2
Molecular Weight 435.56
CAS Registry Number 1309784-09-5
SMILES C[C@@H](C(=O)N(C)C1=CC2=C(C=C1)C=C(N2)C3=NNC4=C3CCC(C4)(C)C)N5CCOCC5
Properties
Density 1.2±0.1 g/cm3, Calc.*
Index of Refraction 1.634, Calc.*
Boiling Point 681.2±55.0 ºC (760 mmHg), Calc.*
Flash Point 365.8±31.5 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbols symbol   GHS07 Warning    Details
Hazard Statements H302-H315-H319-H335    Details
Precautionary Statements P261-P305+P351+P338    Details
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