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114473-81-3 | 2,4-Pyrrolidinedione, 1-phenyl-
CAS No: 114473-81-3 Catalog No: AG000EHO MDL No:MFCD20482733
Product Description
Catalog Number:
AG000EHO
Chemical Name:
2,4-Pyrrolidinedione, 1-phenyl-
CAS Number:
114473-81-3
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD20482733
IUPAC Name:
1-phenylpyrrolidine-2,4-dione
InChI:
InChI=1S/C10H9NO2/c12-9-6-10(13)11(7-9)8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:
YCWRLBFFWYMHAQ-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CN1c1ccccc1
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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