Cas no 52667-88-6 (1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane)

1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane structure
52667-88-6 structure
Product Name:1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane
CAS No:52667-88-6
MF:C36H44N4O8S4
MW:789.016564369202
CID:937278
PubChem ID:2802555
Update Time:2025-04-19

1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane Chemical and Physical Properties

Names and Identifiers

    • 1,4,7,10-tetra-p-tosyl-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-tetrakis-(4-methylphenyl)sulfonyl-1,4,7,10-tetrazacyclododecane
    • 1,4,7,10-Tetratosyl-
    • 1,4,7,10-tetra(p-toluenesulfonyl)-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-tetra(p-tosyl)-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-tetrakis(p-tolylsulfonyl)-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-tetrakis-(toluene-4-sulfonyl)-1,4,7,10-tetraaza-cyclododecane
    • cyclen tetratosylate
    • N,N',N'',N'''-tetrakis(p-toluenesulfonyl)-1,4,7,10-tetraazacyclododecane
    • 52667-88-6
    • 1,4,7,10-tetrakis(p-toluensulfonyl)-1,4,7,10-tetraazacyclododecane
    • 1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclodecane
    • DTXSID70384364
    • SKTWVKMQYXXWNY-UHFFFAOYSA-N
    • AKOS001586436
    • BT4CJZ8VFK
    • SCHEMBL565301
    • 1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane, technical grade
    • 1,4,7,10-Tetraazacyclododecane, 1,4,7,10-tetrakis(p-tolylsulfonyl)-
    • BP-21001
    • 1,4,7,10-Tetrakis[(4-methylphenyl)sulfonyl]-1,4,7,10-tetraazacyclododecane
    • CS-0358038
    • G65000
    • EC 414-030-0
    • NS00001711
    • 1,4,7,10-Tetraazacyclododecane, 1,4,7,10-tetrakis[(4-methylphenyl)sulfonyl]-
    • CCA66788
    • 1,4,7,10-tetrakis(4-methylbenzenesulfonyl)-1,4,7,10-tetraazacyclododecane
    • 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
    • InChI Key： SKTWVKMQYXXWNY-UHFFFAOYSA-N
    • SMILES： S(C1C=CC(C)=CC=1)(N1CCN(CCN(CCN(CC1)S(C1C=CC(C)=CC=1)(=O)=O)S(C1C=CC(C)=CC=1)(=O)=O)S(C1C=CC(C)=CC=1)(=O)=O)(=O)=O

Computed Properties

  • Exact Mass: 788.20400
  • Monoisotopic Mass: 788.20419907g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 52
  • Rotatable Bond Count: 8
  • Complexity: 1310
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 4.8
  • Topological Polar Surface Area: 183?2

Experimental Properties

  • Color/Form: Light brown solid
  • Melting Point: 275-279?°C(lit.)
  • PSA: 183.04000
  • LogP: 8.07200
  • Solubility: Not available

1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane Security Information

  • Hazardous Material transportation number：UN 3077 9/PG 3
  • WGK Germany：2
  • Hazard Category Code： 43-50/53
  • Safety Instruction： S24; S37; S60; S61
  • Hazardous Material Identification： Xi N
  • Risk Phrases：R43; R50/53

1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane Pricemore >>

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1,4,7,10-Tetratosyl-1,4,7,10-tetraazacyclododecane Production Method

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