874569-39-8,MFCD09800724
Catalog No.:AA00IEIY

874569-39-8 | Methyl 3-chloro-4-iodobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$47.00   $33.00
- +
5g
95%
in stock  
$225.00   $158.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IEIY
Chemical Name:
Methyl 3-chloro-4-iodobenzoate
CAS Number:
874569-39-8
Molecular Formula:
C8H6ClIO2
Molecular Weight:
296.4895
MDL Number:
MFCD09800724
SMILES:
COC(=O)c1ccc(c(c1)Cl)I
Properties
Computed Properties
 
Complexity:
174  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Downstream Synthesis Route

[1]Patent:WO2007/79186,2007,A2.Locationinpatent:Page/Pagecolumn46

[1]Patent:WO2007/79186,2007,A2.Locationinpatent:Page/Pagecolumn45

874569-39-8   
8-tert-butyl(dimethyl)silyloxy}-2-azaspiro4.5decan-1-one 
 
methyl4-8-tert-butyl(dimethyl)silyloxy}-1-oxo-2-azaspiro4.5dec-2-yl-3-chlorobenzoate 

[1]Patent:WO2016/177658,2016,A1.Locationinpatent:Page/Pagecolumn303

874569-39-8   
methyl2''-({(4S,5R)-5-3,5-bis(trifluoromethyl)phenyl-4-methyl-2-oxo-1,3-oxazolidin-3-yl}methyl)-2-chloro-4'-methoxy-4''-(trifluoromethyl)-1,1':3',1''-terphenyl-4-carboxylate 
 
methyl2''-({(4S,5R)-5-3,5-bis(trifluoromethyl)phenyl-4-methyl-2-oxo-1,3-oxazolidin-3-yl}methyl)-2-chloro-4'-methoxy-4''-(trifluoromethyl)-1,1':3',1''-terphenyl-4-carboxylate 

[1]Patent:WO2007/79186,2007,A2

[1]Patent:WO2007/79186,2007,A2

Literature
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SDS
Tags:874569-39-8 Molecular Formula|874569-39-8 MDL|874569-39-8 SMILES|874569-39-8 Methyl 3-chloro-4-iodobenzoate
Catalog No.: AA00IEIY
874569-39-8,MFCD09800724
874569-39-8 | Methyl 3-chloro-4-iodobenzoate
Pack Size: 1g
Purity: 95%
in stock
$47.00 $33.00
Pack Size: 5g
Purity: 95%
in stock
$225.00 $158.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IEIY
Chemical Name: Methyl 3-chloro-4-iodobenzoate
CAS Number: 874569-39-8
Molecular Formula: C8H6ClIO2
Molecular Weight: 296.4895
MDL Number: MFCD09800724
SMILES: COC(=O)c1ccc(c(c1)Cl)I
Properties
Complexity: 174  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Downstream Synthesis Route
874569-39-8    5720-07-0    943917-16-6 

[1]Patent:WO2007/79186,2007,A2.Locationinpatent:Page/Pagecolumn46

84228-44-4    874569-39-8 

[1]Patent:WO2007/79186,2007,A2.Locationinpatent:Page/Pagecolumn45

874569-39-8   
8-tert-butyl(dimethyl)silyloxy}-2-azaspiro4.5decan-1-one 
 
methyl4-8-tert-butyl(dimethyl)silyloxy}-1-oxo-2-azaspiro4.5dec-2-yl-3-chlorobenzoate 

[1]Patent:WO2016/177658,2016,A1.Locationinpatent:Page/Pagecolumn303

874569-39-8   
methyl2''-({(4S,5R)-5-3,5-bis(trifluoromethyl)phenyl-4-methyl-2-oxo-1,3-oxazolidin-3-yl}methyl)-2-chloro-4'-methoxy-4''-(trifluoromethyl)-1,1':3',1''-terphenyl-4-carboxylate 
 
methyl2''-({(4S,5R)-5-3,5-bis(trifluoromethyl)phenyl-4-methyl-2-oxo-1,3-oxazolidin-3-yl}methyl)-2-chloro-4'-methoxy-4''-(trifluoromethyl)-1,1':3',1''-terphenyl-4-carboxylate 

[1]Patent:WO2007/79186,2007,A2

874569-39-8    943917-15-5 

[1]Patent:WO2007/79186,2007,A2

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