Diethyl sulfate (C4H10O4S)

Diethyl sulfate (C4H10O4S; CAS 64-67-5) is a practical retrosynthesis target. Diethyl sulfate presents a C4 framework. Open AI route search in one click below.

Target: Diethyl sulfate
CAS: 64-67-5
Formula: C4H10O4S
Approx. MW: 154.18
SMILES: CCOS(=O)(=O)OCC
PubChem CID: 6163
Approx. carbons: C4

Diethyl sulfate structure

Properties

IUPAC name: diethyl sulfate
Common names: Diethyl sulfate; 64-67-5; Diethyl sulphate; Sulfuric acid, diethyl ester; DIETHYLSULFATE; Diaethylsulfat; Sulfuric acid diethyl ester; Diethyl tetraoxosulfate; Diethylester kyseliny sirove; K0FO4VFA7I
Molecular weight: 154.19
Exact mass: 154.03
InChIKey: DENRZWYUOJLTMF-UHFFFAOYSA-N
Melting point: -12 °F (USCG, 1999)
Boiling point: 409 °F at 760 mmHg (USCG, 1999)
Density: 1.1803 at 68 °F (USCG, 1999) - Denser than water; will sink

View on PubChem

Diethyl sulfate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Diethyl sulfate?

Diethyl sulfate has molecular formula C4H10O4S. Molecular weight about 154.18 g·mol⁻¹.

What is the CAS number of Diethyl sulfate?

The CAS Registry Number for Diethyl sulfate is 64-67-5.

Run AI retrosynthesis for Diethyl sulfate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C4H10O4S.

References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.