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14776-43-3 | 3-Pyrazolidinone, 2,5-diphenyl-
CAS No: 14776-43-3 Catalog No: AG001F6Z MDL No:
Product Description
Catalog Number:
AG001F6Z
Chemical Name:
3-Pyrazolidinone, 2,5-diphenyl-
CAS Number:
14776-43-3
Molecular Formula:
C15H14N2O
Molecular Weight:
238.2845
IUPAC Name:
2,5-diphenylpyrazolidin-3-one
InChI:
InChI=1S/C15H14N2O/c18-15-11-14(12-7-3-1-4-8-12)16-17(15)13-9-5-2-6-10-13/h1-10,14,16H,11H2
InChI Key:
RAQBOVMWAGOKDG-UHFFFAOYSA-N
SMILES:
O=C1CC(NN1c1ccccc1)c1ccccc1
NSC Number:
209021
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.29g/mol
Monoisotopic Mass:
238.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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