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Sodium 3-bromopropane-1-sulfonate

  • CAS No. 55788-44-8

  • Cat. No. CS-0187636
  • Purity≥95%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

Sodium 3-bromopropane-1-sulfonate|CS-0187636

Structure of 55788-44-8

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General Information

  • CAS No. 55788-44-8
  • Cat. No. CS-0187636
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₆BrNaO₃S
  • Molecular Weight 225.04
  • Synonym(s) SODIUM3-BROMOPROPANESULPHONATE
  • SMILES C(CBr)CS(=O)(=O)[O-].[Na+]

Description

cis-2-Butene-1, 4-diol is used as a probe for studying isomerization versus hydrogenation and hydrogenolysis reactions. (DPCB-OMe) efficiently catalyzes cyclodehydration of cis-2-butene-1,4-diol with active methylene compounds to give 2-vinyl-2,3-dihydrofurans in good to high yields. Grubbs's cross metathesis of eugenol with cis-2-butene-1, 4-diol to make a natural product, an organometallic experiment.

Application

Sodium 3-bromopropane-1-sulfonate serves as a versatile sulfonate-based alkylating agent, enabling efficient C–S bond formation in nucleophilic substitution reactions. Its stability under ambient conditions and solubility in polar solvents facilitate straightforward handling and purification. The bromide functionality reacts reliably with thiols, amines, and other soft nucleophiles, making it valuable for synthesizing thioether linkages and functionalized heterocycles in medicinal chemistry and materials science applications.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   57.2
  • LogP   -2.6794
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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