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29668-47-1,MFCD02601787
Catalog No.:AA002YYH

29668-47-1 | 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-butanone

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1g
95%
in stock  
$81.00   $57.00
- +
5g
95%
in stock  
$321.00   $225.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002YYH
Chemical Name:
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-butanone
CAS Number:
29668-47-1
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD02601787
SMILES:
CCCC(=O)c1ccc2c(c1)OCCO2
Properties
Computed Properties
 
Complexity:
227  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
1.4  

Downstream Synthesis Route
29668-47-1   
1-(2,3-dihydro-benzo1,4dioxin-6-yl)-butane-1,2-dione-2-oxime 

[1]CurrentPatentAssignee:I.G.FARBENINDUSTRIEAG(historic)-DE619332,1931,C[DRP/DRBPOrg.Chem.][DRP/DRBPOrg.Chem.]

[1]CurrentPatentAssignee:WINTHROPCHEM-US1964973,1932,A

[2]CurrentPatentAssignee:I.G.FARBENINDUSTRIEAG(historic)-DE619332,1931,C[DRP/DRBPOrg.Chem.][DRP/DRBPOrg.Chem.]

29668-47-1   
2-amino-1-(2,3-dihydro-benzo1,4dioxin-6-yl)-butan-1-ol 

[1]CurrentPatentAssignee:I.G.FARBENINDUSTRIEAG(historic)-DE619332,1931,C[DRP/DRBPOrg.Chem.][DRP/DRBPOrg.Chem.]

[1]Locationinpatent:bodytextMochalov;Chasanov;Fedotov;Zefirov[ChemistryofHeterocyclicCompounds,2011,vol.47,#9,p.1105-1121]

[1]Mochalov;Fedotov;Trofimova;Zefirov[RussianJournalofOrganicChemistry,2015,vol.51,#9,p.1217-1231][Zh.Org.Khim.,2015,vol.51,#9,p.1241-1255,15]

[2]Mochalov;Fedotov;Trofimova;Zefirov[RussianJournalofOrganicChemistry,2017,vol.53,#10,p.1514-1519][Zh.Org.Khim.,2017,vol.53,#10,p.1487-1492,6]

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:29668-47-1 Molecular Formula|29668-47-1 MDL|29668-47-1 SMILES|29668-47-1 1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-butanone