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127913-44-4,MFCD00273363
Catalog No.:AA000XHX

127913-44-4 | (S)-4-Chloro-3-hydroxybutyronitrile

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Purity
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Price(USD)
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5g
98%
in stock  
$6.00   $4.00
- +
10g
98%
in stock  
$7.00   $5.00
- +
25g
98%
in stock  
$16.00   $11.00
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100g
98%
in stock  
$52.00   $36.00
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500g
98%
in stock  
$128.00   $89.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000XHX
Chemical Name:
(S)-4-Chloro-3-hydroxybutyronitrile
CAS Number:
127913-44-4
Molecular Formula:
C4H6ClNO
Molecular Weight:
119.5495
MDL Number:
MFCD00273363
SMILES:
O[C@H](CCl)CC#N
Properties
Properties
 
BP:
286.2°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.474(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
84.9  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.1  

Upstream Synthesis Route

[1]LettersinOrganicChemistry,2012,vol.9,#7,p.520-521

[2]Patent:CN108484407,2018,A,.Locationinpatent:Paragraph0028;0029

[1]CatalysisToday,2010,vol.150,#1-2,p.22-27

[1]Synthesis,2004,#16,p.2629-2632

[2]Patent:WO2005/87715,2005,A1,.Locationinpatent:Page/Pagecolumn9-10

[3]Patent:WO2005/87715,2005,A1,.Locationinpatent:Page/Pagecolumn10

[4]Patent:WO2005/87715,2005,A1,.Locationinpatent:Page/Pagecolumn10

[1]Patent:CN107827844,2018,A,.Locationinpatent:Paragraph0026;0027;0028;0029

[1]LettersinOrganicChemistry,2012,vol.9,#7,p.520-521

Downstream Synthesis Route

[1]Tetrahedron,1994,vol.50,p.11821-11826

[2]Tetrahedron,1994,vol.50,p.11821-11826

[1]Tetrahedron,1994,vol.50,p.11821-11826

[2]Tetrahedron,1994,vol.50,p.11821-11826

[1]BioorganicandMedicinalChemistryLetters,1996,vol.6,p.2581-2584

[2]BioorganicandMedicinalChemistryLetters,1996,vol.6,p.2581-2584

[1]TetrahedronAsymmetry,1996,vol.7,p.3109-3112

[1]Heterocycles,2000,vol.53,p.173-181

Literature
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SDS
Tags:127913-44-4 Molecular Formula|127913-44-4 MDL|127913-44-4 SMILES|127913-44-4 (S)-4-Chloro-3-hydroxybutyronitrile