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100610-03-5,MFCD09418666
Catalog No.:AA0002EC

100610-03-5 | Methyl 4-(butylcarbamoyl)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
2 weeks  
$113.00   $79.00
- +
5g
98%
2 weeks  
$338.00   $237.00
- +
25g
98%
2 weeks  
$900.00   $630.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0002EC
Chemical Name:
Methyl 4-(butylcarbamoyl)benzoate
CAS Number:
100610-03-5
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
MDL Number:
MFCD09418666
SMILES:
CCCCNC(=O)c1ccc(cc1)C(=O)OC
Properties
Computed Properties
 
Complexity:
257  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
2.3  

Downstream Synthesis Route

[1]Hotten[IndustrialandEngineeringChemistry,1957,vol.49,p.1691,1692]

[1]Suto,Yutaka;Yamagiwa,Noriyuki;Torisawa,Yasuhiro[TetrahedronLetters,2008,vol.49,#40,p.5732-5735]

[1]Guissart,Céline;Barros,Andre;RosaBarata,Luis;Evano,Gwilherm[OrganicLetters,2018,vol.20,#17,p.5098-5102]

[1]Guissart,Céline;Barros,Andre;RosaBarata,Luis;Evano,Gwilherm[OrganicLetters,2018,vol.20,#17,p.5098-5102]

Literature
Quotation Request
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SDS
Tags:100610-03-5 Molecular Formula|100610-03-5 MDL|100610-03-5 SMILES|100610-03-5 Methyl 4-(butylcarbamoyl)benzoate