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1632002-11-9

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1632002-11-9 Structure

1632002-11-9 Structure
IdentificationBack Directory
[Name]

ESAX-010
[CAS]

1632002-11-9
[Synonyms]

SAX-010
ESAX-010
1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]pyrrole-3-carboxylic acid
1H-Pyrrole-3-carboxylic acid, 1-(2-hydroxyethyl)-4-methyl-5-[2-(trifluoromethyl)phenyl]-, (5S)-
[Molecular Formula]

C15H14F3NO3
[MOL File]

1632002-11-9.mol
[Molecular Weight]

313.27
Chemical PropertiesBack Directory
[Boiling point ]

456.1±45.0 °C(Predicted)
[density ]

1.34±0.1 g/cm3(Predicted)
[pka]

5.43±0.50(Predicted)
[InChI]

InChI=1S/C15H14F3NO3/c1-9-11(14(21)22)8-19(6-7-20)13(9)10-4-2-3-5-12(10)15(16,17)18/h2-5,8,20H,6-7H2,1H3,(H,21,22)
[InChIKey]

IVQABNHAUVXTRE-UHFFFAOYSA-N
[SMILES]

N1(CCO)C(C2=CC=CC=C2C(F)(F)F)=C(C)C(C(O)=O)=C1
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