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39528-61-5,MFCD02657976
Catalog No.:AA00C59W

39528-61-5 | 2,4-Dichlorobenzoylacetonitrile

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Purity
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1g
≥ 99% (HPLC)
in stock  
$308.00   $215.00
- +
5g
≥ 99% (HPLC)
in stock  
$971.00   $680.00
- +
25g
≥ 99% (HPLC)
in stock  
$3,972.00   $2,780.00
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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:
AA00C59W
Chemical Name:
2,4-Dichlorobenzoylacetonitrile
CAS Number:
39528-61-5
Molecular Formula:
C9H5Cl2NO
Molecular Weight:
214.0481
MDL Number:
MFCD02657976
SMILES:
N#CCC(=O)c1ccc(cc1Cl)Cl
Properties
Computed Properties
 
Complexity:
245  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.7  

Downstream Synthesis Route

[1]SyntheticCommunications,1999,vol.29,p.311-341

[1]Patent:US4680401,1987,A

[1]Chirality,2012,vol.24,p.847-853,7

[1]Romagnoli,Romeo;Baraldi,PierGiovanni;Carrion,MariaDora;Cruz-Lopez,Olga;Cara,CarlotaLopez;Saponaro,Giulia;Preti,Delia;Tabrizi,MojganAghazadeh;Baraldi,Stefania;Moorman,AllanR.;Vincenzi,Fabrizio;Borea,PierAndrea;Varani,Katia[BioorganicandMedicinalChemistry,2014,vol.22,#1,p.148-166]

Literature
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Additional Info:
SDS
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Tags:39528-61-5 Molecular Formula|39528-61-5 MDL|39528-61-5 SMILES|39528-61-5 2,4-Dichlorobenzoylacetonitrile