Home Other Building Blocks 1-benzylpyrrolidine-2,4-dione

1-benzylpyrrolidine-2,4-dione

CAS No.:
30125-76-9
Catalog Number:
AG01BH1C
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
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Product Description
Catalog Number:
AG01BH1C
Chemical Name:
1-benzylpyrrolidine-2,4-dione
CAS Number:
30125-76-9
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD21943663
IUPAC Name:
1-benzylpyrrolidine-2,4-dione
InChI:
InChI=1S/C11H11NO2/c13-10-6-11(14)12(8-10)7-9-4-2-1-3-5-9/h1-5H,6-8H2
InChI Key:
QELVYIQQUJJODY-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CN1Cc1ccccc1
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties