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1-Bromocarbonyl-1-methylethyl acetate

CAS 40635-67-4CH3COOC(CH3)2COBrChemical Synthesis

1-Bromocarbonyl-1-methylethyl acetate (CAS: 40635-67-4), with the linear formula CH₃COOC(CH₃)₂COBr, has a molecular weight of 209.04 g/mol. This acid halide serves as a valuable reagent in organic synthesis. Its primary applications include the deoxygenation of vicinal diols and the preparation of dideoxynucleosides, notably 2′,3′-dideoxycytidine, from their corresponding ribo series precursors.

IUPAC
α-Acetoxyisobutyryl bromide,2-Acetoxy-2-methylpropionyl bromide
Synonyms
α-Acetoxyisobutyryl bromide2-Acetoxy-2-methylpropionyl bromide
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1-Bromocarbonyl-1-methylethyl acetate (CH3COOC(CH3)2COBr) — chemical structure, CAS 40635-67-4; Chemistry, fine chemical supplied by Tech Serve Solutions
Acid HalidesBuilding BlocksCarbonyl CompoundsChemical SynthesisOrganic Building Blocks
01 /Applications

Deoxygenation of Vicinal Diols

1-Bromocarbonyl-1-methylethyl acetate acts as a reagent for the efficient deoxygenation of vicinal diols in organic synthesis, enabling the transformation of hydroxyl groups into hydrogen atoms.

Nucleoside Synthesis

This compound is employed in the preparation of dideoxynucleosides, such as 2′,3′-dideoxycytidine, by facilitating the removal of oxygen atoms from the ribose sugar moiety.

Organic Synthesis Building Block

As an acid halide and organic building block, it can be utilised in various synthetic pathways requiring the introduction of an acetoxyisobutyryl group or related functionalities.

02 /Properties
Molecular weight209.04
Linear formulaCH3COOC(CH3)2COBr
Assay96%
Boiling point75-77 °C/12 mmHg(lit.)
Density1.431 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.457(lit.)
Storage temperature2-8°C
ApplicationReagent for deoxygenation of vicinal diols, as well as in the preparation of 2′,3′-dideoxycytidine and other dideoxy and deoxynucleosides from the corresponding ribo series.1
03 /Safety & handling
GHS hazard pictogram: Corrosive (GHS05)
Corrosive
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Danger

Hazard statements

  • H314Causes severe skin burns and eye damage
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P280Wear protective gloves, clothing and eye/face protection
  • P305IF IN EYES
  • P310Immediately call a POISON CENTER or doctor
Protective equipmentFaceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point113 °C / 235.4 °F
Transport (UN / ADR)UN 3265 8 / PGII
Water hazard class (WGK, DE)3
Hazard codes (EU)C
Risk statements (R)14-34-37
Safety statements (S)26-36/37/39-45
Supplemental hazardsReacts violently with water.

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
40635-67-4
MDL number
MFCD00040923
PubChem substance
24862463
Beilstein registry
2432585
05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is 1-Bromocarbonyl-1-methylethyl acetate used for?

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1-Bromocarbonyl-1-methylethyl acetate is used as a reagent for the deoxygenation of vicinal diols and in the preparation of dideoxynucleosides, including 2′,3′-dideoxycytidine.

What is the CAS number and chemical formula?

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The CAS number is 40635-67-4, and the linear formula is CH₃COOC(CH₃)₂COBr.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies 1-Bromocarbonyl-1-methylethyl acetate with a purity of 96% (assay). TSS does not represent this product as USP, BP, EP, or any other pharmacopoeia grade.

How should 1-Bromocarbonyl-1-methylethyl acetate be handled safely?

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This compound is corrosive and may cause respiratory irritation. It reacts violently with water. Handle with extreme care, using appropriate personal protective equipment including a full-face respirator, gloves, and eye protection, and avoid contact with moisture. Refer to the Safety Data Sheet for full details.

Is this product available for export?

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Yes, Tech Serve Solutions is a global supplier and exporter of fine chemicals, including 1-Bromocarbonyl-1-methylethyl acetate.

How can I request a quote or sample?

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Please contact our sales department through the website or by phone to request a quote or a sample of 1-Bromocarbonyl-1-methylethyl acetate.

Need 1-Bromocarbonyl-1-methylethyl acetate in a specific grade or volume?