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115084-80-5 | 2,4-Pyrrolidinedione, 5-(1-methylethyl)-
CAS No: 115084-80-5 Catalog No: AG000FVH MDL No:MFCD19220152
Product Description
Catalog Number:
AG000FVH
Chemical Name:
2,4-Pyrrolidinedione, 5-(1-methylethyl)-
CAS Number:
115084-80-5
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
MDL Number:
MFCD19220152
IUPAC Name:
5-propan-2-ylpyrrolidine-2,4-dione
InChI:
InChI=1S/C7H11NO2/c1-4(2)7-5(9)3-6(10)8-7/h4,7H,3H2,1-2H3,(H,8,10)
InChI Key:
PLFGCAPFRIWBQU-UHFFFAOYSA-N
SMILES:
CC(C1NC(=O)CC1=O)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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