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321-31-3,MFCD00461896
Catalog No.:AA00C0ZA

321-31-3 | 3'-Chloro-2,2,2-trifluoroacetophenone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$16.00   $11.00
- +
5g
95%
in stock  
$52.00   $36.00
- +
  • 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:
AA00C0ZA
Chemical Name:
3'-Chloro-2,2,2-trifluoroacetophenone
CAS Number:
321-31-3
Molecular Formula:
C8H4ClF3O
Molecular Weight:
208.5650
MDL Number:
MFCD00461896
SMILES:
Clc1cccc(c1)C(=O)C(F)(F)F
Properties
Computed Properties
 
Complexity:
202  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
3.6  

Upstream Synthesis Route

[1]TetrahedronLetters,2013,vol.54,#33,p.4483-4486

[2]JournalofFluorineChemistry,2012,vol.137,p.99-104

[3]ChemicalCommunications,2018,vol.54,#78,p.11017-11020

[1]Patent:CN106518636,2017,A,.Locationinpatent:Paragraph0113;0114;0115;0116;0121;0122;0123;0124

[2]OrganicLetters,2017,vol.19,#3,p.588-591

[1]Patent:CN106518636,2017,A,.Locationinpatent:Paragraph0117;0118;0119;0120

[1]Patent:CN106518636,2017,A,.Locationinpatent:Paragraph0125;0126;0127;0128

[1]BioorganicandMedicinalChemistry,2004,vol.12,#5,p.979-993

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1951,vol.73,p.709

[2]Patent:CN110776406,2020,A.Locationinpatent:Paragraph0201;0204

[1]JournaloftheAmericanChemicalSociety,1951,vol.73,p.709

[1]JournaloftheAmericanChemicalSociety,1972,vol.94,p.820-828

[1]BulletinoftheChemicalSocietyofJapan,1990,vol.63,p.1129-1137

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1982,vol.18,p.317-324    ZhurnalOrganicheskoiKhimii,1982,vol.18,p.365-373

Literature
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SDS
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