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4144-22-3 | 1-(tert-Butyl);-1H-pyrrole-2,5-dione
CAS No: 4144-22-3 Catalog No: AG003TDD MDL No:MFCD00191885
Product Description
Catalog Number:
AG003TDD
Chemical Name:
1-(tert-Butyl);-1H-pyrrole-2,5-dione
CAS Number:
4144-22-3
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD00191885
IUPAC Name:
1-tert-butylpyrrole-2,5-dione
InChI:
InChI=1S/C8H11NO2/c1-8(2,3)9-6(10)4-5-7(9)11/h4-5H,1-3H3
InChI Key:
YEKDUBMGZZTUDY-UHFFFAOYSA-N
SMILES:
CC(N1C(=O)C=CC1=O)(C)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Chemical reactivity and antimicrobial activity of N-substituted maleimides. | Journal of enzyme inhibition and medicinal chemistry 20120201 |
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