N-substituted imidazoles

Description:

Heterocyclic compounds containing an imidazole ring substituted at position 1.

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  1. 1-Methylimidazole-d6
    CAS: 285978-27-0 PubChem CID: 11343986 Formula: C4H6N2 Molecular Weight: 88.14
    Out of Stock Item #: M978428
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    Technical Identifiers
    IUPAC Name
    2,4,5-trideuterio-1-(trideuteriomethyl)imidazole
    SMILES
    CN1C=CN=C1
    InChIKey
    MCTWTZJPVLRJOU-RLTMCGQMSA-N
    InChI
    1S/C4H6N2/c1-6-3-2-5-4-6/h2-4H,1H3/i1D3,2D,3D,4D
  2. 1,3-Didodecyl-2-methyl-1H-imidazol-3-ium chloride
    CAS: 21054-71-7 Formula: C28H55ClN2 Molecular Weight: 455.20
    Solid ≥95%
    In Stock Item #: D770309
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    IUPAC Name
    1,3-didodecyl-2-methylimidazol-1-ium;chloride
    SMILES
    CCCCCCCCCCCCN1C=C[N+](=C1C)CCCCCCCCCCCC.[Cl-]
    InChIKey
    ONVPFSYQVOTHPK-UHFFFAOYSA-M
    InChI
    1S/C28H55N2.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-29-26-27-30(28(29)3)25-23-21-19-17-15-13-11-9-7-5-2;/h26-27H,4-25H2,1-3H3;1H/q+1;/p-1
  3. 1-Butyl-3-methylimidazolium perchlorate
    CAS: 220956-35-4 PubChem CID: 71463766 Formula: C8H15ClN2O4 Molecular Weight: 238.67
    Liquid ≥99%
    Out of Stock Item #: B770358
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    IUPAC Name
    1-butyl-3-methylimidazol-3-ium;perchlorate
    SMILES
    CCCCN1C=C[N+](=C1)C.[O-]Cl(=O)(=O)=O
    InChIKey
    OPGGSNAFGYWGCT-UHFFFAOYSA-M
    InChI
    1S/C8H15N2.ClHO4/c1-3-4-5-10-7-6-9(2)8-10;2-1(3,4)5/h6-8H,3-5H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
    Synonyms
    3-Butyl-1-methyl-1H-imidazol-3-ium perchlorate
  4. 1-Methyl-1H-imidazol-3-ium tetrafluoroborate
    CAS: 151200-14-5 PubChem CID: 11788523 Formula: C4H7BF4N2 Molecular Weight: 169.92
    Out of Stock Item #: M770308
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    IUPAC Name
    3-methyl-1H-imidazol-3-ium;tetrafluoroborate
    SMILES
    [B-](F)(F)(F)F.C[N+]1=CNC=C1
    InChIKey
    ULUZIIYGBKXRGN-UHFFFAOYSA-O
    InChI
    1S/C4H6N2.BF4/c1-6-3-2-5-4-6;2-1(3,4)5/h2-4H,1H3;/q;-1/p+1
  5. 1-Isopropyl-2-methylimidazole
    CAS: 84606-45-1 Formula: C7H12N2 Molecular Weight: 124.18568
    Out of Stock Item #: I769083
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    Technical Identifiers
    SMILES
    CC1=NC=CN1C(C)C
    InChIKey
    GDRRCHJTUJBMQA-UHFFFAOYSA-N
    InChI
    1S/C7H12N2/c1-6(2)9-5-4-8-7(9)3/h4-6H,1-3H3
  6. 1-Benzyl-3-methylImidazolium
    CAS: 65039-11-4 PubChem CID: 12392668 Formula: C11H13BrN2 Molecular Weight: 253.14
    Liquid ≥98%
    Out of Stock Item #: B768437
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    IUPAC Name
    1-benzyl-3-methylimidazol-3-ium;bromide
    SMILES
    C[N+]1=CN(C=C1)CC2=CC=CC=C2.[Br-]
    InChIKey
    VBLZTUCAWYJIMG-UHFFFAOYSA-M
    InChI
    1S/C11H13N2.BrH/c1-12-7-8-13(10-12)9-11-5-3-2-4-6-11;/h2-8,10H,9H2,1H3;1H/q+1;/p-1
    Synonyms
    3-Benzyl-1-methyl-1H-imidazol-3-ium bromide | 1-Benzyl-3-methyl-1H-imidazol-3-ium bromide
  7. 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-6-ol
    CAS: 1378606-06-4 PubChem CID: 67356950 Formula: C6H8N2O Molecular Weight: 124.14
    Out of Stock Item #: D770667
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    IUPAC Name
    6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-6-ol
    SMILES
    C1C(CN2C1=NC=C2)O
    InChIKey
    OLXNUSXUUWAEGE-UHFFFAOYSA-N
    InChI
    1S/C6H8N2O/c9-5-3-6-7-1-2-8(6)4-5/h1-2,5,9H,3-4H2
  8. 3-methyl-1-vinyl-1H-imidazolium methyl sulphate
    CAS: 26591-72-0 Formula: C7H14N2O4S Molecular Weight: 222.2621
    Out of Stock Item #: M769136
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    Technical Identifiers
    SMILES
    C[N+]1=CN(C=C1)C=C.COS(=O)(=O)[O-]
    InChIKey
    BZVFPIHTRLNAQA-UHFFFAOYSA-M
    InChI
    1S/C6H9N2.CH4O4S/c1-3-8-5-4-7(2)6-8;1-5-6(2,3)4/h3-6H,1H2,2H3;1H3,(H,2,3,4)/q+1;/p-1
  9. 1,1'-Dimethyl-1H,1'H-2,2'-biimidazole
    CAS: 37570-94-8 PubChem CID: 10123778 Formula: C8H10N4 Molecular Weight: 162.19
    Out of Stock Item #: D770134
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    Technical Identifiers
    IUPAC Name
    1-methyl-2-(1-methylimidazol-2-yl)imidazole
    SMILES
    CN1C=CN=C1C2=NC=CN2C
    InChIKey
    KMRPQHUALQQSPI-UHFFFAOYSA-N
    InChI
    1S/C8H10N4/c1-11-5-3-9-7(11)8-10-4-6-12(8)2/h3-6H,1-2H3
  10. 1,2-Bis(1-methyl-1H-imidazol-2-yl)disulfane
    CAS: 61747-29-3 PubChem CID: 12297468 Formula: C8H10N4S2 Molecular Weight: 226.3
    Out of Stock Item #: B768812
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    Technical Identifiers
    IUPAC Name
    1-methyl-2-[(1-methylimidazol-2-yl)disulfanyl]imidazole
    SMILES
    CN1C=CN=C1SSC2=NC=CN2C
    InChIKey
    VWGKCNYHKYTHBR-UHFFFAOYSA-N
    InChI
    1S/C8H10N4S2/c1-11-5-3-9-7(11)13-14-8-10-4-6-12(8)2/h3-6H,1-2H3
  11. 1-Methyl-3-tetradecyl-1H-imidazol-3-ium chloride
    CAS: 171058-21-2 Formula: C18H35ClN2 Molecular Weight: 314.94
    Solid ≥98%
    In Stock Item #: T770783
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    IUPAC Name
    1-methyl-3-tetradecylimidazol-1-ium;chloride
    SMILES
    CCCCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
    InChIKey
    SDXDXENAFAXVMX-UHFFFAOYSA-M
    InChI
    1S/C18H35N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-17-16-19(2)18-20;/h16-18H,3-15H2,1-2H3;1H/q+1;/p-1
    Synonyms
    1-Tetradecyl-3-methylimidazolium chloride | 1-Methyl-3-tetradecylimidazolium chloride | DTXSID1049229 | DTXCID7029085...
  12. 1-hexadecyl-3-methylimidazol-3-ium,tetrafluoroborate
    CAS: 244193-64-4 EC Number: 801-471-2 Formula: C20H39N2.BF4 Molecular Weight: 394.35
    Solid ≥98%
    Out of Stock Item #: H770229
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    Technical Identifiers
    IUPAC Name
    1-hexadecyl-3-methylimidazol-3-ium;tetrafluoroborate
    SMILES
    [B-](F)(F)(F)F.CCCCCCCCCCCCCCCCN1C=C[N+](=C1)C
    InChIKey
    WXCIBNGOVJQXTI-UHFFFAOYSA-N
    InChI
    1S/C20H39N2.BF4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-19-18-21(2)20-22;2-1(3,4)5/h18-20H,3-17H2,1-2H3;/q+1;-1
    Synonyms
    1-Cetyl-3-methylimidazolium tetrafluoroborate | 1-Hexadecyl-3-methyl-1H-imidazolium tetrafluoroborate
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