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123-56-8 | 2,5-Pyrrolidinedione
CAS No: 123-56-8 Catalog No: AG000JX1 MDL No:MFCD00005495
Product Description
Catalog Number:
AG000JX1
Chemical Name:
2,5-Pyrrolidinedione
CAS Number:
123-56-8
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
MDL Number:
MFCD00005495
IUPAC Name:
pyrrolidine-2,5-dione
InChI:
InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
InChI Key:
KZNICNPSHKQLFF-UHFFFAOYSA-N
SMILES:
O=C1CCC(=O)N1
EC Number:
204-635-6
UNII:
10X90O3503
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.032g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
99.089g/mol
Monoisotopic Mass:
99.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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