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102222-08-2 | 2-Pyrrolidinone, 1,3-dibenzoyl-
CAS No: 102222-08-2 Catalog No: AG0006YV MDL No:
Product Description
Catalog Number:
AG0006YV
Chemical Name:
2-Pyrrolidinone, 1,3-dibenzoyl-
CAS Number:
102222-08-2
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
IUPAC Name:
1,3-dibenzoylpyrrolidin-2-one
InChI:
InChI=1S/C18H15NO3/c20-16(13-7-3-1-4-8-13)15-11-12-19(18(15)22)17(21)14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChI Key:
FHOOFUWCTRSCPD-UHFFFAOYSA-N
SMILES:
O=C(C1CCN(C1=O)C(=O)c1ccccc1)c1ccccc1
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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