1019650-80-6,MFCD19347433
Catalog No.:AA00H9MK

1019650-80-6 | 2-Pyrrolidinone, 4-(3-methylphenyl)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$358.00   $251.00
- +
1g
97%
in stock  
$820.00   $574.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00H9MK
Chemical Name:
2-Pyrrolidinone, 4-(3-methylphenyl)
CAS Number:
1019650-80-6
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD19347433
SMILES:
O=C1NCC(C1)c1cccc(c1)C
Properties
Computed Properties
 
Complexity:
202  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

methyl2-carbomethoxy-4-nitro-3-(3-methylphenyl)butyrate 
  1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

2-oxo-4-(3-methylphenyl)pyrrolidine-3-carboxylicacid 
  1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

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Tags:1019650-80-6 Molecular Formula|1019650-80-6 MDL|1019650-80-6 SMILES|1019650-80-6 2-Pyrrolidinone, 4-(3-methylphenyl)
Catalog No.: AA00H9MK
1019650-80-6,MFCD19347433
1019650-80-6 | 2-Pyrrolidinone, 4-(3-methylphenyl)
Pack Size: 250mg
Purity: 97%
in stock
$358.00 $251.00
Pack Size: 1g
Purity: 97%
in stock
$820.00 $574.00
Quantity
- +
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Technical Information
Catalog Number: AA00H9MK
Chemical Name: 2-Pyrrolidinone, 4-(3-methylphenyl)
CAS Number: 1019650-80-6
Molecular Formula: C11H13NO
Molecular Weight: 175.2270
MDL Number: MFCD19347433
SMILES: O=C1NCC(C1)c1cccc(c1)C
Properties
Complexity: 202  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
Downstream Synthesis Route
620-23-5    1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

methyl2-carbomethoxy-4-nitro-3-(3-methylphenyl)butyrate 
  1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

79133-32-7    1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

2-oxo-4-(3-methylphenyl)pyrrolidine-3-carboxylicacid 
  1019650-80-6 

[1]Montoya-Balbás,IrisJ.;Valentín-Guevara,Berenice;López-Mendoza,Estefanía;Linzaga-Elizalde,Irma;Ordoñez,Mario;Román-Bravo,Perla[Molecules,2015,vol.20,#12,p.22028-22043]

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