Fluorinated Building Blocks
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TrifluoromethanesulfonanilideCas#: 456-64-4 Compound CID: 68012Formula: C7H6F3NO2S Molecular Weight: 225.19IUPAC Name: 1,1,1-trifluoro-N-phenylmethanesulfonamideSMILES: C1=CC=C(C=C1)NS(=O)(=O)C(F)(F)FInChIKey: OXDSKEQSEGDAFN-UHFFFAOYSA-NInChI: InChI=1S/C7H6F3NO2S/c8-7(9,10)14(12,13)11-6-4-2-1-3-5-6/h1-5,11HSynonyms: N-Phenyl-1,1,1-trifluoromethanesulfonamide | BB 0304059 | HMS1784H08 | N-[(Trifluoromethyl)sulfonyl]aniline | N-pheny...
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7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic AcidCas#: 100361-18-0 Compound CID: 11055142Formula: C12H8ClFN2O3 Molecular Weight: 282.66IUPAC Name: 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acidSMILES: C1CC1N2C=C(C(=O)C3=CC(=C(N=C32)Cl)F)C(=O)OInChIKey: OXNZWNNMJBOZQO-UHFFFAOYSA-NInChI: InChI=1S/C12H8ClFN2O3/c13-10-8(14)3-6-9(17)7(12(18)19)4-16(5-1-2-5)11(6)15-10/h3-5H,1-2H2,(H,18,19)Synonyms: 1-Cyclopropyl-6-fluoro-7-chloro-4-oxo-1,4-dihydro-1,8-napthyridine-3-carboxylic acid | 7-chloro-1-cyclopropyl-6-fluor...
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7-(Dimethylamino)-4-(trifluoromethyl)coumarinCas#: 53518-14-2 Compound CID: 104522Formula: C12H10F3NO2 Molecular Weight: 257.21IUPAC Name: 7-(dimethylamino)-4-(trifluoromethyl)chromen-2-oneSMILES: CN(C)C1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)FInChIKey: KDTAEYOYAZPLIC-UHFFFAOYSA-NInChI: InChI=1S/C12H10F3NO2/c1-16(2)7-3-4-8-9(12(13,14)15)6-11(17)18-10(8)5-7/h3-6H,1-2H3Synonyms: 7-(Dimethylamino)-4-(trifluoromethyl)coumarin | coumarin-152 | COUMARIN 485 | Q27122742 | NSC2652 | 7-dimethylamino-4...
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Heneicosafluoroundecanoic AcidCas#: 2058-94-8 Compound CID: 77222Formula: C11HF21O2 Molecular Weight: 564.09IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecanoic acidSMILES: C(=O)(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OInChIKey: SIDINRCMMRKXGQ-UHFFFAOYSA-NInChI: InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34)Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosakis(fluoranyl)undecanoic acid | PFUnA | AKOS015852634 | Perflu...
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2,3,5,6-Tetrafluoro-4-methylbenzoic AcidCas#: 652-32-4 Compound CID: 69548Formula: C8H4F4O2 Molecular Weight: 208.11IUPAC Name: 2,3,5,6-tetrafluoro-4-methylbenzoic acidSMILES: CC1=C(C(=C(C(=C1F)F)C(=O)O)F)FInChIKey: COOULIOYEXBFDT-UHFFFAOYSA-NInChI: InChI=1S/C8H4F4O2/c1-2-4(9)6(11)3(8(13)14)7(12)5(2)10/h1H3,(H,13,14)Synonyms: 2,3,5,6-Tetrafluoro-p-toluic acid | NSC168718 | NSC-168718 | 2,3,5,6-tetrafluoro-4-toluic acid | EN300-8679935 | CBDi...
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3'-Fluoro-4'-hydroxyacetophenoneCas#: 403-14-5 Compound CID: 2737325Formula: C8H7FO2 Molecular Weight: 154.14IUPAC Name: 1-(3-fluoro-4-hydroxyphenyl)ethanoneSMILES: CC(=O)C1=CC(=C(C=C1)O)FInChIKey: GSWTXZXGONEVJC-UHFFFAOYSA-NInChI: InChI=1S/C8H7FO2/c1-5(10)6-2-3-8(11)7(9)4-6/h2-4,11H,1H3Synonyms: F0843 | FT-0615684 | STL215803 | AKOS002338354 | CS-W002525 | 3//'-Fluoro-4//'-hydroxyacetophenone | EN300-68878 | 3 ...
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3-Fluoro-DL-phenylalanineCas#: 456-88-2 Compound CID: 9976Formula: FC6H4CH2CH(NH2)COOH Molecular Weight: 183.18IUPAC Name: 2-amino-3-(3-fluorophenyl)propanoic acidSMILES: C1=CC(=CC(=C1)F)CC(C(=O)O)NInChIKey: VWHRYODZTDMVSS-UHFFFAOYSA-NInChI: InChI=1S/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)Synonyms: 3-Fluoro-dl-phenylalanine|456-88-2|2629-54-1|H-DL-PHE(3-F)-OH|3-Fluorophenylalanine|2-amino-3-(3-fluorophenyl)propano...
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4-Trifluoromethylbenzoic AnhydrideCas#: 25753-16-6 Compound CID: 2760733Formula: C16H8F6O3 Molecular Weight: 362.23IUPAC Name: [4-(trifluoromethyl)benzoyl] 4-(trifluoromethyl)benzoateSMILES: C1=CC(=CC=C1C(=O)OC(=O)C2=CC=C(C=C2)C(F)(F)F)C(F)(F)FInChIKey: FNAWJOBKLWLHTA-UHFFFAOYSA-NInChI: InChI=1S/C16H8F6O3/c17-15(18,19)11-5-1-9(2-6-11)13(23)25-14(24)10-3-7-12(8-4-10)16(20,21)22/h1-8HSynonyms: 4-Trifluoromethylbenzoic Anhydride | FT-0638547 | A817997 | [4-(trifluoromethyl)benzoyl] 4-(trifluoromethyl)benzoate ...
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4-Fluoro-N-methylbenzylamineCas#: 405-66-3 Compound CID: 736860Formula: C8H10FN Molecular Weight: 139.17IUPAC Name: 1-(4-fluorophenyl)-N-methylmethanamineSMILES: CNCC1=CC=C(C=C1)FInChIKey: SZJIQLSCDIEJFC-UHFFFAOYSA-NInChI: InChI=1S/C8H10FN/c1-10-6-7-2-4-8(9)5-3-7/h2-5,10H,6H2,1H3Synonyms: FT-0646196 | NCGC00374043-01 | 4-Fluoro-N-methylbenzyl amine | (4-fluorobenzyl)-(methyl)-amine | (4-fluoro-benzyl)-me...
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(2,4-Difluorophenyl)-4-piperidylmethanone Oxime HydrochlorideCas#: 135634-18-3 Compound CID: 19886359Formula: C12H14F2N2O·HCl Molecular Weight: 276.71IUPAC Name: (NE)-N-[(2,4-difluorophenyl)-piperidin-4-ylmethylidene]hydroxylamine;hydrochlorideSMILES: C1CNCCC1C(=NO)C2=C(C=C(C=C2)F)F.ClInChIKey: CPVWKXXFKMUDPA-CLNHMMGSSA-NInChI: InChI=1S/C12H14F2N2O.ClH/c13-9-1-2-10(11(14)7-9)12(16-17)8-3-5-15-6-4-8;/h1-2,7-8,15,17H,3-6H2;1H/b16-12+;Synonyms: (NE)-N-[(2,4-difluorophenyl)-piperidin-4-ylmethylidene]hydroxylamine;hydrochloride | (2,4-Difluorophenyl)(piperidin-4...
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1,1'-[1,4-Phenylenebis(methylene)]bis(4,4'-bipyridinium) Bis(hexafluorophosphate)Cas#: 108861-20-7 Compound CID: 11061517Formula: C28H24F12N4P2 Molecular Weight: 706.46IUPAC Name: 4-pyridin-4-yl-1-[[4-[(4-pyridin-4-ylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium;dihexafluorophosphateSMILES: C1=CC(=CC=C1C[N+]2=CC=C(C=C2)C3=CC=NC=C3)C[N+]4=CC=C(C=C4)C5=CC=NC=C5.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)FInChIKey: ZURJGCCXYLZWSO-UHFFFAOYSA-NInChI: InChI=1S/C28H24N4.2F6P/c1-2-24(22-32-19-11-28(12-20-32)26-7-15-30-16-8-26)4-3-23(1)21-31-17-9-27(10-18-31)25-5-13-29-14-6-25;2*1-7(2,3,4,5)6/h1-20H,21-22H2;;/q+2;2*-1Synonyms: 1,1'-[1,4-phenylenebis(methylene)]bis(4,4'-bipyridinium)bis(hexafluorophosphate) | 1,1'-[1,4-Phenylenebis(methylene)]...
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1,4-Bis(1,2-dibromoethyl)benzeneCas#: 25393-98-0 Compound CID: 97018Formula: C10H10Br4 Molecular Weight: 449.81IUPAC Name: 1,4-bis(1,2-dibromoethyl)benzeneSMILES: C1=CC(=CC=C1C(CBr)Br)C(CBr)BrInChIKey: KDBQQANTDCVPDZ-UHFFFAOYSA-NInChI: InChI=1S/C10H10Br4/c11-5-9(13)7-1-2-8(4-3-7)10(14)6-12/h1-4,9-10H,5-6H2Synonyms: DTXSID40948250 | AKOS024429510 | FT-0638519 | p-Bis(1,2-dibromoethyl)benzene | AS-75509 | Benzene, 1,4-bis(1,2-dibrom...