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20595-53-3,MFCD00179444
Catalog No.:AA002ACO

20595-53-3 | 3-(3,5-Dichlorophenyl)acrylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$13.00   $9.00
- +
1g
98%
in stock  
$32.00   $22.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002ACO
Chemical Name:
3-(3,5-Dichlorophenyl)acrylic acid
CAS Number:
20595-53-3
Molecular Formula:
C9H6Cl2O2
Molecular Weight:
217.0487
MDL Number:
MFCD00179444
SMILES:
OC(=O)/C=C/c1cc(Cl)cc(c1)Cl
Properties
Computed Properties
 
Complexity:
206  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.1  

Downstream Synthesis Route

[1]Patent:US2020/197375,2020,A1.Locationinpatent:Paragraph0146

[2]JournalofMedicinalChemistry,1987,vol.30,p.486-494

[3]JournaloftheChemicalSociety,1958,p.4064,4068

[4]JournalofMedicinalChemistry,2003,vol.46,p.409-416

[5]Tetrahedron,2016,vol.72,p.7256-7262

[6]BioorganicandMedicinalChemistry,2017,vol.25,p.5726-5732

[1]JournaloftheChemicalSociety,1958,p.4064,4068

20595-53-3   
(2<i>RS</i>:3<i>SR</i>)-2,3-dibromo-3-(3,5-dichloro-phenyl)-propionicacid 

[1]MonatsheftefurChemie,1933,vol.62,p.344,347

[1]ArkivfoerKemi,1958,vol.12,p.267,273

[1]MonatsheftefurChemie,1933,vol.62,p.344,347

Literature
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SDS
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Tags:20595-53-3 Molecular Formula|20595-53-3 MDL|20595-53-3 SMILES|20595-53-3 3-(3,5-Dichlorophenyl)acrylic acid