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[3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol

CAS 171916-75-9C9H12BrN3O3Chemical Synthesis

[3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol (CAS: 171916-75-9) is a chiral building block with the molecular formula C9H12BrN3O3. This compound is valuable in asymmetric synthesis and organic chemistry due to its specific stereochemistry and functional groups. It serves as a key intermediate in the synthesis of complex organic molecules and finds applications in chemical biology and conjugation chemistry, particularly involving azide functionalities.

Synonyms
7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol, C9H12BrN3O3
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[3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol (C9H12BrN3O3) — chemical structure, CAS 171916-75-9; Chemistry, fine chemical supplied by Tech Serve Solutions
Asymmetric SynthesisAzidesChemical BiologyChemical SynthesisChiral Building BlocksAlkynes and Other ReagentsOrganic Azides
01 /Applications

Asymmetric Synthesis

Utilised as a chiral building block in stereoselective synthesis to construct complex molecules with defined stereochemistry. Its unique structure allows for controlled introduction of functional groups.

Organic Azide Chemistry

Functions as a precursor in reactions involving organic azides, such as click chemistry or the synthesis of nitrogen-containing heterocycles. The azide group is a versatile functional handle for further transformations.

Chemical Biology Research

Employed in studies requiring the incorporation of specific structural motifs for biological probes or labelled compounds. Its chiral nature can be important for studying stereospecific interactions.

Intermediate in Complex Synthesis

Serves as a key intermediate in multi-step synthetic pathways towards pharmaceuticals or other high-value organic compounds. The bromo and azido substituents offer distinct reaction sites.

02 /Properties
Molecular weight290.11
Empirical formulaC9H12BrN3O3
Assay99%
Optical activity[α]25/D +24°, c = 1 in chloroform
Storage temperature−20°C
Melting point116-118 °C(lit.)
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P305IF IN EYES
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)36/37/38
Safety statements (S)26

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

04 /Identifiers & registry
CAS number
171916-75-9
MDL number
MFCD01863546
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 [3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol primarily used for?

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This compound is primarily used as a chiral building block in asymmetric synthesis, organic azide chemistry, and as an intermediate in the synthesis of complex organic molecules for chemical biology research.

What are the CAS number and molecular formula for this chemical?

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The CAS number is 171916-75-9, and the molecular formula is C9H12BrN3O3.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies this chemical with a minimum assay of 99%. This product is intended for research and laboratory use, and TSS does not represent it as USP, BP, EP, or other pharmacopoeial grades.

How should this chemical be handled safely?

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This chemical is classified as a Warning. It may cause skin irritation (H315), serious eye irritation (H319), and respiratory irritation (H335). Handle with appropriate personal protective equipment, ensuring good ventilation, and avoid breathing dust/fume/gas/mist/vapours/spray. In case of contact with eyes, rinse cautiously with water for several minutes (P305 + P351 + P338).

Is this chemical available for export?

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Yes, Tech Serve Solutions is a specialist global supplier and exporter of fine chemicals. Please contact us for export details and shipping options.

How can I request a sample or quote?

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To request a sample or a quote for [3aS-(3aα,4α,5β,7aα)]-5-Azido-7-bromo-3a,4,5,7a-tetrahydro-2,2-dimethyl-1,3-benzodioxol-4-ol, please visit our website or contact our sales team directly.

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