Fluorobenzenes

Description:

Compounds containing one or more fluorine atoms attached to a benzene ring.

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  1. 2,3,5,6-Tetrafluorotoluene
    CAS: 5230-78-4 EC Number: 226-028-5 Formula: C7H4F4 Molecular Weight: 164.10
    Liquid ≥95%
    Out of Stock Item #: T1073503
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    IUPAC Name
    1,2,4,5-tetrafluoro-3-methylbenzene
    SMILES
    CC1=C(C(=CC(=C1F)F)F)F
    InChIKey
    POMGTQLCZJZYAM-UHFFFAOYSA-N
    InChI
    1S/C7H4F4/c1-3-6(10)4(8)2-5(9)7(3)11/h2H,1H3
  2. 1-{[2-(2,4-Difluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole monomethanesulfonate
    CAS: 86386-77-8 EC Number: 617-843-0 PubChem CID: 13059700 Formula: C12H13F2N3O4S Molecular Weight: 333.31
    Out of Stock Item #: D1344398
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    IUPAC Name
    1-[[2-(2,4-difluorophenyl)oxiran-2-yl]methyl]-1,2,4-triazole;methanesulfonic acid
    SMILES
    CS(=O)(=O)O.C1C(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)F)F
    InChIKey
    NJBRNNOGZPVNNR-UHFFFAOYSA-N
    InChI
    1S/C11H9F2N3O.CH4O3S/c12-8-1-2-9(10(13)3-8)11(5-17-11)4-16-7-14-6-15-16;1-5(2,3)4/h1-3,6-7H,4-5H2;1H3,(H,2,3,4)
  3. Fluorapacin
    CAS: 869811-23-4 Formula: C14H12F2S3 Molecular Weight: 314.4
    Out of Stock Item #: F1337499
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    IUPAC Name
    1-fluoro-4-[[(4-fluorophenyl)methyltrisulfanyl]methyl]benzene
    SMILES
    C1=CC(=CC=C1CSSSCC2=CC=C(C=C2)F)F
    InChIKey
    XCOWUOOCXCXCNS-UHFFFAOYSA-N
    InChI
    1S/C14H12F2S3/c15-13-5-1-11(2-6-13)9-17-19-18-10-12-3-7-14(16)8-4-12/h1-8H,9-10H2
  4. CID 16722711
    CAS: 935467-97-3 PubChem CID: 16722711
    Out of Stock Item #: C1337757
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    IUPAC Name
    [(3S,5R)-3,5-bis(4-fluorophenyl)-1,3,5,7-tetrahydro-[1,3]oxazolo[3,4-c][1,3]oxazol-7a-yl]methanol
    SMILES
    C1C2(COC(N2C(O1)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)CO
    InChIKey
    AEZQGSQEXPUADE-JWTNVVGKSA-N
    InChI
    1S/C18H17F2NO3/c19-14-5-1-12(2-6-14)16-21-17(13-3-7-15(20)8-4-13)24-11-18(21,9-22)10-23-16/h1-8,16-17,22H,9-11H2/t16-,17+,18?
  5. tert-Butyl ((2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl)carbamate
    CAS: 1172623-99-2 PubChem CID: 86713019
    Out of Stock Item #: T769830
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    IUPAC Name
    tert-butyl N-[(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxyoxan-3-yl]carbamate
    SMILES
    CC(C)(C)OC(=O)NC1CC(COC1C2=C(C=CC(=C2)F)F)O
    InChIKey
    RYDSJJXCDQFTKF-INPHSSGZSA-N
    InChI
    1S/C16H21F2NO4/c1-16(2,3)23-15(21)19-13-7-10(20)8-22-14(13)11-6-9(17)4-5-12(11)18/h4-6,10,13-14,20H,7-8H2,1-3H3,(H,19,21)/t10?,13-,14+/m0/s1
  6. potassium (3-chloro-4-fluorophenyl)(trifluoro)borate(1-)
    CAS: 850623-59-5 PubChem CID: 23716863 Formula: C6H3BClF4K Molecular Weight: 236.44
    Out of Stock Item #: P770614
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    IUPAC Name
    potassium;(3-chloro-4-fluorophenyl)-trifluoroboranuide
    SMILES
    [B-](C1=CC(=C(C=C1)F)Cl)(F)(F)F.[K+]
    InChIKey
    YIBSBTTVMHWMNU-UHFFFAOYSA-N
    InChI
    1S/C6H3BClF4.K/c8-5-3-4(7(10,11)12)1-2-6(5)9;/h1-3H;/q-1;+1
  7. Potassium (3,5-difluorophenyl)trifluoroborate
    CAS: 267006-26-8 PubChem CID: 23681893 Formula: C6H3BF5K Molecular Weight: 219.99
    Powder ≥98%
    Out of Stock Item #: P768947
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    IUPAC Name
    potassium;(3,5-difluorophenyl)-trifluoroboranuide
    SMILES
    [B-](C1=CC(=CC(=C1)F)F)(F)(F)F.[K+]
    InChIKey
    JFSPHPHYZHGKPO-UHFFFAOYSA-N
    InChI
    1S/C6H3BF5.K/c8-5-1-4(7(10,11)12)2-6(9)3-5;/h1-3H;/q-1;+1
  8. A-967079
    CAS: 1170613-55-4 PubChem CID: 42641861 Formula: C12H14FNO Molecular Weight: 207.24
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: A768939
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    IUPAC Name
    (NE)-N-[(E)-1-(4-fluorophenyl)-2-methylpent-1-en-3-ylidene]hydroxylamine
    SMILES
    CCC(=NO)C(=CC1=CC=C(C=C1)F)C
    InChIKey
    HKROEBDHHKMNBZ-CHBKHGQFSA-N
    InChI
    1S/C12H14FNO/c1-3-12(14-15)9(2)8-10-4-6-11(13)7-5-10/h4-8,15H,3H2,1-2H3/b9-8+,14-12+
    Synonyms
    1-Penten-3-one, 1-(4-fluorophenyl)-2-methyl-, oxime, (1E,3E)
  9. 4-(3-fluorophenyl)tetrahydro-2H-pyran-4-carbonitrile
    CAS: 1035261-79-0 PubChem CID: 43119033 Formula: C12H12FNO Molecular Weight: 205.232
    Solid ≥90%
    Out of Stock Item #: T769056
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    Technical Identifiers
    IUPAC Name
    4-(3-fluorophenyl)oxane-4-carbonitrile
    SMILES
    C1COCCC1(C#N)C2=CC(=CC=C2)F
    InChIKey
    ISKQMVJXZOBQJH-UHFFFAOYSA-N
    InChI
    1S/C12H12FNO/c13-11-3-1-2-10(8-11)12(9-14)4-6-15-7-5-12/h1-3,8H,4-7H2
  10. 4-(2-fluorophenyl)tetrahydro-2H-pyran-4-carbonitrile
    CAS: 859164-45-7 Formula: C12H12FNO Molecular Weight: 205.09
    Solid ≥90%
    Out of Stock Item #: T769016
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    Technical Identifiers
    SMILES
    C1COCCC1(C#N)C2=CC=CC=C2F
    InChIKey
    JOYSNTZJNYCWMW-UHFFFAOYSA-N
    InChI
    1S/C12H12FNO/c13-11-4-2-1-3-10(11)12(9-14)5-7-15-8-6-12/h1-4H,5-8H2
  11. 2-Bromo-1-chloro-3,4-difluorobenzene
    CAS: 1208077-25-1 PubChem CID: 50998371 Formula: C6H2BrClF2 Molecular Weight: 227.43
    Out of Stock Item #: B769060
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    Technical Identifiers
    IUPAC Name
    2-bromo-1-chloro-3,4-difluorobenzene
    SMILES
    C1=CC(=C(C(=C1F)F)Br)Cl
    InChIKey
    MWGRISBCIIDKSD-UHFFFAOYSA-N
    InChI
    1S/C6H2BrClF2/c7-5-3(8)1-2-4(9)6(5)10/h1-2H
  12. 1,4-Dibromo-2-fluoro-3-methylbenzene
    CAS: 1000576-44-2 PubChem CID: 44891117 Formula: C7H5Br2F Molecular Weight: 267.923
    Out of Stock Item #: D770887
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    Technical Identifiers
    IUPAC Name
    1,4-dibromo-2-fluoro-3-methylbenzene
    SMILES
    CC1=C(C=CC(=C1F)Br)Br
    InChIKey
    DIHFJZRFCAKXCU-UHFFFAOYSA-N
    InChI
    1S/C7H5Br2F/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,1H3
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