Description

Sulfuric acid, dipropyl ester (CAS 598-05-0), also known as dipropyl sulfate, is a high-purity organic sulfate ester with the molecular formula C₆H₁₄O₄S. This compound is widely utilized in chemical synthesis and industrial applications due to its role as an alkylating agent. It is supplied as a clear, colorless to pale yellow liquid with a characteristic ester-like odor. Suitable for laboratory and research use, this reagent is rigorously tested for consistency and purity, ensuring optimal performance in specialized reactions. Proper handling under inert conditions is recommended due to its reactivity.

Properties

• CAS Number: 598-05-0
• Complexity: 154
• IUPAC Name: dipropyl sulfate
• InChI: InChI=1S/C6H14O4S/c1-3-5-9-11(7,8)10-6-4-2/h3-6H2,1-2H3
• InChI Key: JYCKNDWZDXGNBW-UHFFFAOYSA-N
• Exact Mass: 182.06128010
• Molecular Formula: C6H14O4S
• Molecular Weight: 182.24
• SMILES: CCCOS(=O)(=O)OCCC
• Topological: 61
• Monoisotopic Mass: 182.06128010
• Synonyms: Dipropyl sulfate, 598-05-0, Sulfuric acid, dipropyl ester, CCRIS 9256, DTXSID6060503, JYCKNDWZDXGNBW-UHFFFAOYSA-, DTXCID2042696, inchi=1/c6h14o4s/c1-3-5-9-11(7,8)10-6-4-2/h3-6h2,1-2h3, di-n-Propyl sulfate, sulfuric acid dipropyl ester, Dipropyl sulphate, dipropylsulfat, di-n-propylsulfate, dipropyl sulfuric acid, di-n-propylsulfuric acid, Sulfuric acid,dipropylester, Sulphuric acid dipropyl ester, SCHEMBL301444, MFCD00059243, AKOS028108566, FD61059, AS-87527, DB-256144, D1638, D89896, Dipropyl sulfate, allkylating agent, >=97.0% (GC)

Application

Dipropyl sulfate is primarily employed as an alkylating agent in organic synthesis, facilitating the introduction of propyl groups into target molecules. It finds applications in the preparation of specialty chemicals, pharmaceuticals, and agrochemical intermediates. Researchers also utilize it in esterification and sulfonation reactions under controlled conditions. Due to its reactivity, it is often handled in anhydrous environments to prevent hydrolysis.

Safety and Hazards

GHS Hazard Statements

• H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Precautionary Statements

• P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

Hazard Classes and Categories

• Skin Corr. 1B (100%)

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