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Structure

1,3-propanediol Di-p-toluenesulfonate

CAS
5469-66-9
Catalog Number
ACM5469669
Category
Other Products
Molecular Weight
384.47
Molecular Formula
C17H20O6S2

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Specification

Synonyms
1,3-Propanediol di-p-tosylate, 317551_ALDRICH, Trimethylene glycol di-p-tosylate, NSC25205, ST5409203, 3-([(4-Methylphenyl)sulfonyl]oxy)propyl 4-methylbenzenesulfonate, 5469-66-9
IUPAC Name
3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCCCOS(=O)(=O)C2=CC=C(C=C2)C
InChI Key
ODVREDGIWSDQFD-UHFFFAOYSA-N
Boiling Point
563.1ºC at 760mmHg
Melting Point
90-92ºC
Flash Point
294.4ºC
Density
1.3g/cm³
Appearance
WHITE POWDER, CRYSTALS, CRYSTALLINE POWDER,AND/OR CHUNKS
EC Number
611-186-3
Exact Mass
384.07000
Hazard Statements
Xn: Harmful;
H-Bond Acceptor
6
H-Bond Donor
0
Safety Description
S36/37/39
WGK Germany
3

Upstream Synthesis Route 1

  • 98-59-9
  • 504-63-2
  • 5469-66-9

Reference: [1]Biological and Pharmaceutical Bulletin,1999,vol. 22,p. 590 - 597

Downstream Synthesis Route 1

  • 5469-66-9
  • 627-31-6

Reference: [1] Bulletin de la Societe Chimique de France, 1961, p. 369 - 371

Downstream Synthesis Route 2

  • 5469-66-9
  • 105-53-3
  • 3779-29-1

Reference: [1] Molecular Crystals and Liquid Crystals (1969-1991), 1989, vol. 168, p. 229 - 246

Downstream Synthesis Route 3

  • 5469-66-9
  • 108-95-2
  • 726-44-3

Reference: [1]Bulletin de la Societe Chimique de France,1961,p. 369 - 371

Downstream Synthesis Route 4

  • 56187-04-3
  • 5469-66-9
  • 35980-65-5

Reference: [1]Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry,2002,vol. 41,p. 372 - 375
[2]Synthetic Communications,2006,vol. 36,p. 1569 - 1573
[3]Australian Journal of Chemistry,1984,vol. 37,p. 959 - 970

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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