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20458-52-0 | 1H-Pyrrole-2,5-dione, 1-decyl-
CAS No: 20458-52-0 Catalog No: AG0029KT MDL No:
Product Description
Catalog Number:
AG0029KT
Chemical Name:
1H-Pyrrole-2,5-dione, 1-decyl-
CAS Number:
20458-52-0
Molecular Formula:
C14H23NO2
Molecular Weight:
237.3379
IUPAC Name:
1-decylpyrrole-2,5-dione
InChI:
InChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-15-13(16)10-11-14(15)17/h10-11H,2-9,12H2,1H3
InChI Key:
PZQWVKKXPIZFHC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCN1C(=O)C=CC1=O
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.343g/mol
Monoisotopic Mass:
237.173g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Design, synthesis, and biochemical evaluation of N-substituted maleimides as inhibitors of prostaglandin endoperoxide synthases. | Journal of medicinal chemistry 19960412 |
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