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54589-54-7,MFCD07781453
Catalog No.:AA00I9OB

54589-54-7 | Ethyl 3-chloromethylbenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$12.00   $8.00
- +
25g
98%
in stock  
$36.00   $25.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I9OB
Chemical Name:
Ethyl 3-chloromethylbenzoate
CAS Number:
54589-54-7
Molecular Formula:
C10H11ClO2
Molecular Weight:
198.6461
MDL Number:
MFCD07781453
SMILES:
CCOC(=O)c1cccc(c1)CCl
Properties
Properties
 
BP:
292.3°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
1.5280 to 1.5320  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
170  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
2.5  

Downstream Synthesis Route

[1]OrganicLetters,2011,vol.13,p.1690-1693

[2]BioorganicChemistry,2000,vol.28,p.98-118

[3]Phosphorus,SulfurandSiliconandtheRelatedElements,1991,vol.60,p.209-214

[4]JournaloftheChemicalSociety,1926,p.1262

[5]JournalofPharmacyandPharmacology,1991,vol.43,p.750-757

[6]EuropeanJournalofOrganicChemistry,2001,p.1917-1926

54589-54-7    15435-71-9   
3-(2-acetyl-3-oxo-butyl)-benzoicacidethylester 

[1]JournaloftheChemicalSociety,1926,p.1262

54589-54-7    63-74-1   
3-(4-sulfamoyl-anilinomethyl)-benzoicacidethylester 

[1]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1950,vol.70,p.535    Chem.Abstr.,1951,p.6171

[1]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1950,vol.70,p.535    Chem.Abstr.,1951,p.6171

[1]Patent:FR2228047,1974,    Patent:CH599752,1977,    Chem.Abstr.,vol.83

Literature
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SDS
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