5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
- CAS NO.:356068-93-4
- Empirical Formula: C16H13FN2O3
- Molecular Weight: 300.28
- MDL number: MFCD11521323
- EINECS: 1592732-453-0
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-06-19 22:07:10
What is 5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid?
Chemical properties
Brown crystals
The Uses of 5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
Des-N-(2-Diethylaminoethyl)amide Sunitinib Acid is an impurity of Sunitinib (S819995), a multi-kinase inhibitor targeting several receptor tyrosine kinases (RTK). Antineoplastic.
Properties of 5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
Melting point: | 320 °C (decomp) |
Boiling point: | 588.4±50.0 °C(Predicted) |
Density | 1.454±0.06 g/cm3(Predicted) |
storage temp. | Sealed in dry,Room Temperature |
solubility | Aqueous Base (Slightly, Heated), DMSO (Slightly, Heated) |
form | Solid |
pka | 5.79±0.50(Predicted) |
color | Dark Orange |
InChI | InChI=1S/C16H13FN2O3/c1-7-13(18-8(2)14(7)16(21)22)6-11-10-5-9(17)3-4-12(10)19-15(11)20/h3-6,18H,1-2H3,(H,19,20)(H,21,22)/b11-6- |
Safety information for 5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
Computed Descriptors for 5-((Z)-(5-Fluoro-2-oxoindolin-3-ylidene)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
InChIKey | RBHBOUYXUXWCNJ-WDZFZDKYSA-N |
SMILES | N1C(/C=C2/C3=C(NC/2=O)C=CC(F)=C3)=C(C)C(C(O)=O)=C1C |
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product: 356068-93-4 5-[(Z)(5-Fluoro-2-oxo-1,2-dihydro-indol-3-ylidenemethyl)]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid 98%
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