Benzenesulfonate esters

Description:

Arenesulfonate esters that result from the formal condensation of the hydroxy group of an alcohol, enol, phenol or heteroarenol with benzenesulfonic acid.

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  1. Piperazine sultosylate
    CAS: 57775-27-6 EC Number: 260-944-6 Formula: C17H22N2O7S2 Molecular Weight: 430.5
    Out of Stock Item #: P1234897
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    IUPAC Name
    2-hydroxy-5-(4-methylphenyl)sulfonyloxybenzenesulfonic acid;piperazine
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)O)S(=O)(=O)O.C1CNCCN1
    InChIKey
    HGAVKWUHBLHFNP-UHFFFAOYSA-N
    InChI
    1S/C13H12O7S2.C4H10N2/c1-9-2-5-11(6-3-9)22(18,19)20-10-4-7-12(14)13(8-10)21(15,16)17;1-2-6-4-3-5-1/h2-8,14H,1H3,(H,15,16,17);5-6H,1-4H2
  2. tert-Butyl 4-methylbenzenesulfonate
    CAS: 4664-57-7 Formula: C11H16O3S Molecular Weight: 228.31
    Liquid ≥98%
    Out of Stock Item #: T769972
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    Technical Identifiers
    IUPAC Name
    tert-butyl 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OC(C)(C)C
    InChIKey
    DLRDEMODNIPHMU-UHFFFAOYSA-N
    InChI
    1S/C11H16O3S/c1-9-5-7-10(8-6-9)15(12,13)14-11(2,3)4/h5-8H,1-4H3
    Synonyms
    tert-Butyl Tosylate
  3. [(3S,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)tetra hydrofuran-3-yl]methyl 4-chlorobenzenesulfonate
    CAS: 175712-02-4 PubChem CID: 46223299 Formula: C20H18ClF2N3O4S Molecular Weight: 469.9
    Out of Stock Item #: T770210
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    Technical Identifiers
    IUPAC Name
    [(3S,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methyl 4-chlorobenzenesulfonate
    SMILES
    C1C(COC1(CN2C=NC=N2)C3=C(C=C(C=C3)F)F)COS(=O)(=O)C4=CC=C(C=C4)Cl
    InChIKey
    WUPORSBDFSRGHD-XOBRGWDASA-N
    InChI
    1S/C20H18ClF2N3O4S/c21-15-1-4-17(5-2-15)31(27,28)30-10-14-8-20(29-9-14,11-26-13-24-12-25-26)18-6-3-16(22)7-19(18)23/h1-7,12-14H,8-11H2/t14-,20-/m0/s1
  4. Pentyl 4-methylbenzenesulfonate
    CAS: 4450-76-4 PubChem CID: 78195 Formula: C12H18O3S Molecular Weight: 242.34
    Out of Stock Item #: P770477
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    Technical Identifiers
    IUPAC Name
    pentyl 4-methylbenzenesulfonate
    SMILES
    CCCCCOS(=O)(=O)C1=CC=C(C=C1)C
    InChIKey
    KOUCTZDKTJGHSS-UHFFFAOYSA-N
    InChI
    1S/C12H18O3S/c1-3-4-5-10-15-16(13,14)12-8-6-11(2)7-9-12/h6-9H,3-5,10H2,1-2H3
  5. Benzyl-PEG5-Ots
    CAS: 129086-10-8 PubChem CID: 10814656 Formula: C24H34O8S Molecular Weight: 482.6
    Out of Stock Item #: B768465
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    IUPAC Name
    2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCOCCOCC2=CC=CC=C2
    InChIKey
    DKGINCKIMWNUHS-UHFFFAOYSA-N
    InChI
    1S/C24H34O8S/c1-22-7-9-24(10-8-22)33(25,26)32-20-19-30-16-15-28-12-11-27-13-14-29-17-18-31-21-23-5-3-2-4-6-23/h2-10H,11-21H2,1H3
  6. 3-hydroxy-3-methylbutyl 4-methylbenzenesulfonate
    CAS: 17689-66-6 PubChem CID: 14001295 Formula: C12H18O4S Molecular Weight: 258.339
    Out of Stock Item #: H770206
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    Technical Identifiers
    IUPAC Name
    (3-hydroxy-3-methylbutyl) 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)(C)O
    InChIKey
    GGLYIKZLOPXYOV-UHFFFAOYSA-N
    InChI
    1S/C12H18O4S/c1-10-4-6-11(7-5-10)17(14,15)16-9-8-12(2,3)13/h4-7,13H,8-9H2,1-3H3
  7. 2-(Benzofuran-3-yl)ethyl 4-methylbenzenesulfonate
    CAS: 26278-25-1 Formula: C17H16O4S Molecular Weight: 316.37
    Out of Stock Item #: E770919
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    Technical Identifiers
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCCC2=COC3=CC=CC=C32
    InChIKey
    OEJOFPWUQPRTDR-UHFFFAOYSA-N
    InChI
    1S/C17H16O4S/c1-13-6-8-15(9-7-13)22(18,19)21-11-10-14-12-20-17-5-3-2-4-16(14)17/h2-9,12H,10-11H2,1H3
  8. 5-((tert-Butoxycarbonyl)amino)pentyl 4-methylbenzenesulfonate
    CAS: 118811-34-0 PubChem CID: 10832186 Formula: C17H27NO5S Molecular Weight: 357.5
    Out of Stock Item #: A725091
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    Technical Identifiers
    IUPAC Name
    5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCCCCCNC(=O)OC(C)(C)C
    InChIKey
    RAOOQXZPVIXTHJ-UHFFFAOYSA-N
    InChI
    1S/C17H27NO5S/c1-14-8-10-15(11-9-14)24(20,21)22-13-7-5-6-12-18-16(19)23-17(2,3)4/h8-11H,5-7,12-13H2,1-4H3,(H,18,19)
  9. (S)-3-(Benzyloxy)-2-Hydroxypropyl 4-Methylbenzenesulfonate
    CAS: 16495-04-8 PubChem CID: 13644870 Formula: C17H20O5S Molecular Weight: 336.4
    Out of Stock Item #: H727619
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    Technical Identifiers
    IUPAC Name
    [(2S)-2-hydroxy-3-phenylmethoxypropyl] 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCC(COCC2=CC=CC=C2)O
    InChIKey
    HBMUWOSOGHUWSS-INIZCTEOSA-N
    InChI
    1S/C17H20O5S/c1-14-7-9-17(10-8-14)23(19,20)22-13-16(18)12-21-11-15-5-3-2-4-6-15/h2-10,16,18H,11-13H2,1H3/t16-/m0/s1
  10. tert-Butyl 3-((tosyloxy)methyl)pyrrolidine-1-carboxylate
    CAS: 114214-70-9 PubChem CID: 20067158 Formula: C17H25NO5S Molecular Weight: 355.45
    Out of Stock Item #: T729717
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    Technical Identifiers
    IUPAC Name
    tert-butyl 3-[(4-methylphenyl)sulfonyloxymethyl]pyrrolidine-1-carboxylate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCC2CCN(C2)C(=O)OC(C)(C)C
    InChIKey
    WPYAOABDDALQSO-UHFFFAOYSA-N
    InChI
    1S/C17H25NO5S/c1-13-5-7-15(8-6-13)24(20,21)22-12-14-9-10-18(11-14)16(19)23-17(2,3)4/h5-8,14H,9-12H2,1-4H3
  11. 4-(Neopentyloxysulfonyl)benzeneboronic acid
    CAS: 957060-74-1 PubChem CID: 44119175 Formula: C11H17BO5S Molecular Weight: 272.13
    Out of Stock Item #: B732008
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    Technical Identifiers
    IUPAC Name
    [4-(2,2-dimethylpropoxysulfonyl)phenyl]boronic acid
    SMILES
    B(C1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)C)(O)O
    InChIKey
    HDSWCPUGAFITCT-UHFFFAOYSA-N
    InChI
    1S/C11H17BO5S/c1-11(2,3)8-17-18(15,16)10-6-4-9(5-7-10)12(13)14/h4-7,13-14H,8H2,1-3H3
  12. 3-FLUOROPROPYL P-TOLUENESULFONATE
    CAS: 312-68-5 PubChem CID: 6366774 Formula: C10H13FO3S Molecular Weight: 232.27
    Out of Stock Item #: F709813
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    Technical Identifiers
    IUPAC Name
    3-fluoropropyl 4-methylbenzenesulfonate
    SMILES
    CC1=CC=C(C=C1)S(=O)(=O)OCCCF
    InChIKey
    PYCKJIAEKJWSKM-UHFFFAOYSA-N
    InChI
    1S/C10H13FO3S/c1-9-3-5-10(6-4-9)15(12,13)14-8-2-7-11/h3-6H,2,7-8H2,1H3
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