Prop-2-yn-1-yl acetate

Name: Prop-2-yn-1-yl acetate
Brand: ChemScene
Availability: InStock
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CAS No. 627-09-8
Cat. No. CS-0158541
Purity≥95%
MDL No.MFCD00041601

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 627-09-8

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General Information

CAS No. 627-09-8
Cat. No. CS-0158541
Purity ≥95%
MDL No. MFCD00041601
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅H₆O₂
Molecular Weight 98.10
Synonym(s) Propargyl acetate
SMILES C#CCOC(=O)C

Application

Propargylacetate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized alkynes and heterocycles. Its compatibility with copper-catalyzed azide-alkyne cycloaddition (CuAAC) facilitates reliable click chemistry applications. The molecule exhibits good bench stability, ease of handling, and tolerance to common functional groups, making it well-suited for multi-step synthesis and scale-up processes.

Synthesis

Route1
- 107-19-7
- 75-36-5
- ~10%
- In-stock
  
  627-09-8
References
- Yadav, Veejendra K.; Babu, K. Ganesh Journal of Organic Chemistry, 2004 , vol. 69, # 2 p. 577 - 580
Route2
- 107-19-7
- 64-19-7
- ~83%
- In-stock
  
  627-09-8
References
- Chakraborti, Asit K.; Gulhane, Rajesh Chemical Communications, 2003 , # 15 p. 1896 - 1897
Route3
- 108-24-7
- 107-19-7
- ~99%
- In-stock
  
  627-09-8
References
- Chakraborti, Asit K.; Gulhane, Rajesh Tetrahedron Letters, 2003 , vol. 44, # 35 p. 6749 - 6753

Safety Information

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GHS Pictogram :	GHS No : GHS02,GHS06
Signal Word : Danger	UN#: 1992
Class : 3(6.1)	Packing Group : Ⅲ
Hazard Statements : H226-H301-H312+H332
Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P370+P378-P405-P501

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Computational Chemistry Data

TPSA 26.3
LogP 0.1827
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ester

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Prop-2-yn-1-yl acetate

CAS No. 627-09-8

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