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7151-49-7 | 1-benzyl-4-methylpyrrolidine-2,3-dione
CAS No: 7151-49-7 Catalog No: AG005H4N MDL No:
Product Description
Catalog Number:
AG005H4N
Chemical Name:
1-benzyl-4-methylpyrrolidine-2,3-dione
CAS Number:
7151-49-7
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
IUPAC Name:
1-benzyl-4-methylpyrrolidine-2,3-dione
InChI:
InChI=1S/C12H13NO2/c1-9-7-13(12(15)11(9)14)8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChI Key:
AMOUGNHQQAQEIZ-UHFFFAOYSA-N
SMILES:
CC1CN(C(=O)C1=O)Cc1ccccc1
NSC Number:
70155
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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