1,4,7,10-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,7,10-tetraazacyclododecane

CAS Registry Number®

52667-88-6

CAS Name

1,4,7,10-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,7,10-tetraazacyclododecane

Molecular Formula

C36H44N4O8S4

Molecular Mass

789.02

Cite this Page

1,4,7,10-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,7,10-tetraazacyclododecane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52667-88-6 (retrieved 2024-11-22) (CAS RN: 52667-88-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    296 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C36H44N4O8S4/c1-29-5-13-33(14-6-29)49(41,42)37-21-23-38(50(43,44)34-15-7-30(2)8-16-34)25-27-40(52(47,48)36-19-11-32(4)12-20-36)28-26-39(24-22-37)51(45,46)35-17-9-31(3)10-18-35/h5-20H,21-28H2,1-4H3

InChIKey

InChIKey=SKTWVKMQYXXWNY-UHFFFAOYSA-N

SMILES

S(=O)(=O)(N1CCN(S(=O)(=O)C2=CC=C(C)C=C2)CCN(S(=O)(=O)C3=CC=C(C)C=C3)CCN(S(=O)(=O)C4=CC=C(C)C=C4)CC1)C5=CC=C(C)C=C5

Canonical SMILES

O=S(=O)(C1=CC=C(C=C1)C)N2CCN(CCN(CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C)S(=O)(=O)C5=CC=C(C=C5)C

Other Names for this Substance

  • 1,4,7,10-Tetraazacyclododecane, 1,4,7,10-tetrakis[(4-methylphenyl)sulfonyl]-
  • 1,4,7,10-Tetraazacyclododecane, 1,4,7,10-tetrakis(p-tolylsulfonyl)-
  • 1,4,7,10-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,7,10-tetraazacyclododecane
  • 1,4,7,10-Tetrakis(p-tolylsulfonyl)-1,4,7,10-tetraazacyclododecane
  • 1,4,7,10-Tetra(p-tosyl)-1,4,7,10-tetraazacyclododecane

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