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15667-63-7,MFCD00010336
Catalog No.:AA001OTZ

15667-63-7 | 3-Butenenitrile, 2-(acetyloxy)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
>97.0%(GC)
in stock  
$75.00   $53.00
- +
1g
>97.0%(GC)
in stock  
$111.00   $78.00
- +
5g
>97.0%(GC)
in stock  
$263.00   $184.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001OTZ
Chemical Name:
3-Butenenitrile, 2-(acetyloxy)-
CAS Number:
15667-63-7
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD00010336
SMILES:
CC(=O)OC(C#N)C=C
NSC Number:
46585
Properties
Properties
 
BP:
74 °C / 16mmHg  
Form:
Liquid  
Refractive Index:
1.4230-1.4250  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
165  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.7  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ZHEJIANGNHUCO.,LTD.-CN111100036,2020,ALocationinpatent:Paragraph0035-0057

[2]CurrentPatentAssignee:ZHEJIANGUNIVERSITY;ZHEJIANGNHUCO.,LTD.-CN111393321,2020,ALocationinpatent:Paragraph0094;0103-0108;0117-0122;0131-0136;0145-0150

[3]vanderSleen[RecueildesTravauxChimiquesdesPays-Bas,1902,vol.21,p.227]

[1]Rambaud,R.;Vessiere,M.[BulletindelaSocieteChimiquedeFrance,1961,p.1567-1571]

[1]Stach,Hans;Huggenberg,Walter;Hesse,Manfred[HelveticaChimicaActa,1987,vol.70,p.369-374]

[2]CurrentPatentAssignee:HONGHUCITYYITAITECH-CN109912416,2019,ALocationinpatent:Paragraph0052;0053

[1]Hosokawa;Aoki;Murahashi[Synthesis,1992,#6,p.558-561]

[2]Hosokawa;Aoki;Murahashi[Synthesis,1992,#6,p.558-561]

[1]Stach,Hans;Huggenberg,Walter;Hesse,Manfred[HelveticaChimicaActa,1987,vol.70,p.369-374]

[2]CurrentPatentAssignee:VITAAPI;SIMON-WO2018/115497,2018,A1Locationinpatent:Page/Pagecolumn77;78

[3]CurrentPatentAssignee:HONGHUCITYYITAITECH-CN109912416,2019,ALocationinpatent:Paragraph0050;0051

Literature

Title: The effect of chlorination on organocyanide compounds.

Journal: Water environment research : a research publication of the Water Environment Federation 20020101

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SDS
Tags:15667-63-7 Molecular Formula|15667-63-7 MDL|15667-63-7 SMILES|15667-63-7 3-Butenenitrile, 2-(acetyloxy)-