Fluorinated Building Blocks

Explore fluorinated building blocks for medicinal chemistry, agrochemical design, and route development. Use these intermediates to introduce fluorine-containing motifs that tune potency, stability, and physicochemical properties.

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  1. 1-Trifluoromethyl-1,2-benziodoxol-3-(1H)-one
    CAS: 887144-94-7 PubChem CID: 24850981 Formula: C8H4F3IO2 Molecular Weight: 316.02
    In Stock Item #: T189226
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    Technical Identifiers
    IUPAC Name
    1-(trifluoromethyl)-1λ3,2-benziodoxol-3-one
    SMILES
    C1=CC=C2C(=C1)C(=O)OI2C(F)(F)F
    InChIKey
    XHEOXSQMBWJOKP-UHFFFAOYSA-N
    InChI
    1S/C8H4F3IO2/c9-8(10,11)12-6-4-2-1-3-5(6)7(13)14-12/h1-4H
    Synonyms
    DHY074A7WG | Togni's reagents carbonyl compound [MI] | FT-0603356 | FT-0685225 | EN300-136055 | MFCD18800706 | 1-Trif...
  2. 1-Trifluoromethylcyclopropane-1-carboxylicAcid
    CAS: 277756-46-4 PubChem CID: 2778306 Formula: C5H5F3O2 Molecular Weight: 154.09
    In Stock Item #: T137562
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    IUPAC Name
    1-(trifluoromethyl)cyclopropane-1-carboxylic acid
    SMILES
    C1CC1(C(=O)O)C(F)(F)F
    InChIKey
    SKCBKBCACWDALV-UHFFFAOYSA-N
    InChI
    1S/C5H5F3O2/c6-5(7,8)4(1-2-4)3(9)10/h1-2H2,(H,9,10)
    Synonyms
    FT-0608323 | 1-(Trifluoromethyl)cyclopropane-1-carboxylic acid | CYCLOPROPANECARBOXYLIC ACID, 1-(TRIFLUOROMETHYL)- | ...
  3. 1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole
    CAS: 887144-97-0 PubChem CID: 16043572 Formula: C10H10F3IO Molecular Weight: 330.09
    In Stock Item #: T162595
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    Technical Identifiers
    IUPAC Name
    3,3-dimethyl-1-(trifluoromethyl)-1λ3,2-benziodoxole
    SMILES
    CC1(C2=CC=CC=C2I(O1)C(F)(F)F)C
    InChIKey
    HVAPLSNCVYXFDQ-UHFFFAOYSA-N
    InChI
    1S/C10H10F3IO/c1-9(2)7-5-3-4-6-8(7)14(15-9)10(11,12)13/h3-6H,1-2H3
    Synonyms
    Q27257820 | DTXSID60457819 | SCHEMBL9935361 | 1-trifluoromethyl-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole | 3,3-Dimet...
  4. Lithium 1,1,2,2,3,3-Hexafluoropropane-1,3-disulfonimide
    CAS: 189217-62-7 EC Number: 680-104-6 PubChem CID: 44630347 Formula: C3F6LiNO4S2 Molecular Weight: 299.09
    In Stock Item #: L157760
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    IUPAC Name
    lithium;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide
    SMILES
    [Li+].C1(C(S(=O)(=O)[N-]S(=O)(=O)C1(F)F)(F)F)(F)F
    InChIKey
    VKQJSJGVEJXINS-UHFFFAOYSA-N
    InChI
    1S/C3F6NO4S2.Li/c4-1(5)2(6,7)15(11,12)10-16(13,14)3(1,8)9;/q-1;+1
    Synonyms
    4,4,5,5,6,6-Hexafluoroperhydro-1,3,2-dithiazine 1,1,3,3-Tetraoxide Lithium Salt
  5. 5-Bromo-1,2,3-trifluorobenzene
    CAS: 138526-69-9 EC Number: 418-480-9 Formula: BrC6H2F3 Molecular Weight: 210.98
    Liquid ≥99%
    In Stock Item #: B120672
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    Technical Identifiers
    IUPAC Name
    5-bromo-1,2,3-trifluorobenzene
    SMILES
    C1=C(C=C(C(=C1F)F)F)Br
    InChIKey
    HKJCELUUIFFSIN-UHFFFAOYSA-N
    InChI
    1S/C6H2BrF3/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
    Synonyms
    1-Bromo-3,4,5-trifluorobenzene | 1,2,3-trifluoro-5-bromobenzene | 3,4,5-Trifluoro Bromo Benzene | 5-Bromo-1,2,3-trifl...
  6. 5-Bromo-1,3-difluoro-2-iodobenzene
    CAS: 160976-02-3 Formula: C6H2BrF2I Molecular Weight: 318.89
    In Stock Item #: B133240
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    Technical Identifiers
    IUPAC Name
    5-bromo-1,3-difluoro-2-iodobenzene
    SMILES
    C1=C(C=C(C(=C1F)I)F)Br
    InChIKey
    NLWAKVGODLJALJ-UHFFFAOYSA-N
    InChI
    1S/C6H2BrF2I/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
    Synonyms
    A810211 | B3058 | 4-bromo-2,6-difluoro-1-iodobenzene | AKOS005254968 | FT-0746828 | Benzene, 5-bromo-1,3-difluoro-2-i...
  7. N-Methyl-3-(trifluoromethyl)aniline
    CAS: 2026-70-2 EC Number: 196-260-9 Formula: C8H8F3N Molecular Weight: 175.15
    Liquid ≥98%
    Out of Stock Item #: N182583
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    Technical Identifiers
    IUPAC Name
    N-methyl-3-(trifluoromethyl)aniline
    SMILES
    CNC1=CC=CC(=C1)C(F)(F)F
    InChIKey
    SRTKIHVQZYXHHJ-UHFFFAOYSA-N
    InChI
    1S/C8H8F3N/c1-12-7-4-2-3-6(5-7)8(9,10)11/h2-5,12H,1H3
    Synonyms
    FT-0683493 | N-methyl-3-trifluoromethylaniline | FS-2363 | MFCD07368696 | A879746 | SCHEMBL1420853 | methyl-(3-triflu...
  8. 4,4,4-Trifluoro-1-phenyl-1,3-butanedione(BTA)
    CAS: 326-06-7 EC Number: 206-307-8 PubChem CID: 67589 Formula: C6H5COCH2COCF3 Molecular Weight: 216.16
    Solid ≥98%
    In Stock Item #: T121509
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    IUPAC Name
    4,4,4-trifluoro-1-phenylbutane-1,3-dione
    SMILES
    C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
    InChIKey
    VVXLFFIFNVKFBD-UHFFFAOYSA-N
    InChI
    1S/C10H7F3O2/c11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7/h1-5H,6H2
    Synonyms
    1, 4,4,4-trifluoro-1-phenyl- | 1,1,1-Trifluoro-4-phenyl-2,4-butanedione | 4,4,4-Trifluoro-1-phenyl-butane-1,3-dione |...
  9. 4,5-Difluoro-2-nitrobenzoic acid
    CAS: 20372-63-8 Formula: C7F2H3NO4 Molecular Weight: 203.1
    In Stock Item #: D113493
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    Technical Identifiers
    IUPAC Name
    4,5-difluoro-2-nitrobenzoic acid
    SMILES
    C1=C(C(=CC(=C1F)F)[N+](=O)[O-])C(=O)O
    InChIKey
    HGGRAOYTQNFGGN-UHFFFAOYSA-N
    InChI
    1S/C7H3F2NO4/c8-4-1-3(7(11)12)6(10(13)14)2-5(4)9/h1-2H,(H,11,12)
    Synonyms
    Z905162660 | D3555 | 3,4-difluoro-6-nitrobenzoic acid | DTXSID80400963 | HGGRAOYTQNFGGN-UHFFFAOYSA-N | FT-0601393 | 2...
  10. 4,5-Difluoro-2-methylbenzoic acid
    CAS: 183237-86-7 Formula: C8H6F2O2 Molecular Weight: 172.13
    In Stock Item #: D120461
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    Technical Identifiers
    IUPAC Name
    4,5-difluoro-2-methylbenzoic acid
    SMILES
    CC1=CC(=C(C=C1C(=O)O)F)F
    InChIKey
    LDMHYYGJZWDBQL-UHFFFAOYSA-N
    InChI
    1S/C8H6F2O2/c1-4-2-6(9)7(10)3-5(4)8(11)12/h2-3H,1H3,(H,11,12)
    Synonyms
    MFCD08062377 | SS-4656 | FT-0653240 | AM61361 | 4,5-Difluoro-2-methylbenzoic acid | DTXSID50590865 | LDMHYYGJZWDBQL-U...
  11. 4,4'-Difluorobenzhydryl Chloride
    CAS: 27064-94-4 Formula: C13H9ClF2 Molecular Weight: 238.66
    In Stock Item #: C134572
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    Technical Identifiers
    IUPAC Name
    1-[chloro-(4-fluorophenyl)methyl]-4-fluorobenzene
    SMILES
    C1=CC(=CC=C1C(C2=CC=C(C=C2)F)Cl)F
    InChIKey
    FHPNLCLHMNPLEW-UHFFFAOYSA-N
    InChI
    1S/C13H9ClF2/c14-13(9-1-5-11(15)6-2-9)10-3-7-12(16)8-4-10/h1-8,13H
    Synonyms
    SCHEMBL424538 | bis-(4-fluorophenyl)methyl chloride | bis(4-fluorophenyl)methyl chloride | chlorobis-(4-fluorophenyl)...
  12. 6-Amino-2,3-difluorophenol
    CAS: 115551-33-2 Formula: C6H5F2NO Molecular Weight: 145.11
    Solid ≥98%
    Out of Stock Item #: D179719
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    Technical Identifiers
    IUPAC Name
    6-amino-2,3-difluorophenol
    SMILES
    C1=CC(=C(C(=C1N)O)F)F
    InChIKey
    KRURHZHJEDNBCM-UHFFFAOYSA-N
    InChI
    1S/C6H5F2NO/c7-3-1-2-4(9)6(10)5(3)8/h1-2,10H,9H2
    Synonyms
    3,4-Difluoro-2-hydroxyaniline | SY015436 | 2-hydroxy 3,4-difluoro aniline | Phenol,6-amino-2,3-difluoro- | D81749 | F...
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Frequently Asked Questions

How do I find the right Fluorinated Building Blocks for my target?
Start with retrosynthetic analysis to identify key disconnections. Filter by functional group, ring system, and protecting group strategy. Match purity grade to your scale — research scale tolerates lower purity than process chemistry.
What specifications matter for Fluorinated Building Blocks?
Purity (≥95% typical, ≥98% for medicinal chemistry), regioisomer purity, water content for moisture-sensitive groups, stereochemistry for chiral compounds, and pack size. Check storage requirements and shelf life.
Are stereochemically pure variants available?
Yes. For chiral building blocks, enantiomeric and diastereomeric purity ratings are provided. Look for compounds with ≥99% ee for asymmetric synthesis applications.
How can I search for specific structures?
Use the filters by functional group, ring system, halogen content, or molecular weight range. You can also search by CAS number, SMILES string, or molecular formula for exact-match queries.

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