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ChemicalBook--->CAS DataBase List--->1332698-41-5

1332698-41-5

1332698-41-5 Structure

1332698-41-5 Structure
IdentificationBack Directory
[Name]

Benzoic acid, 4-[5-(3,5-dichloro-4-fluorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-2-methyl-
[CAS]

1332698-41-5
[Synonyms]

4-(5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-2-methylbenzoic acid
4-[5-(3,5-Dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydro-3-isoxazolyl]-2-methylbenzoic Acid
Benzoic acid, 4-[5-(3,5-dichloro-4-fluorophenyl)-4,5-dihydro-5-(trifluoromethyl)-3-isoxazolyl]-2-methyl-
[Molecular Formula]

C18H11Cl2F4NO3
[MOL File]

1332698-41-5.mol
[Molecular Weight]

436.18
Chemical PropertiesBack Directory
[Boiling point ]

510.5±60.0 °C(Predicted)
[density ]

1.54±0.1 g/cm3(Predicted)
[pka]

3.61±0.25(Predicted)
[InChI]

InChI=1S/C18H11Cl2F4NO3/c1-8-4-9(2-3-11(8)16(26)27)14-7-17(28-25-14,18(22,23)24)10-5-12(19)15(21)13(20)6-10/h2-6H,7H2,1H3,(H,26,27)
[InChIKey]

KVDAGBPQBOYRKB-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC=C(C2CC(C3=CC(Cl)=C(F)C(Cl)=C3)(C(F)(F)F)ON=2)C=C1C
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