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87476-39-9 | 2-Pyrrolidinone, 1,1'-[(4-chlorophenyl)methylene]bis-
CAS No: 87476-39-9 Catalog No: AG004FNA MDL No:
Product Description
Catalog Number:
AG004FNA
Chemical Name:
2-Pyrrolidinone, 1,1'-[(4-chlorophenyl)methylene]bis-
CAS Number:
87476-39-9
Molecular Formula:
C15H17ClN2O2
Molecular Weight:
292.7607
IUPAC Name:
1-[(4-chlorophenyl)-(2-oxopyrrolidin-1-yl)methyl]pyrrolidin-2-one
InChI:
InChI=1S/C15H17ClN2O2/c16-12-7-5-11(6-8-12)15(17-9-1-3-13(17)19)18-10-2-4-14(18)20/h5-8,15H,1-4,9-10H2
InChI Key:
MTPTUJAQQNIIBW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(N1CCCC1=O)N1CCCC1=O
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.098g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.763g/mol
Monoisotopic Mass:
292.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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