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89733-44-8 | 1H-Pyrrole-2,5-dione, 3-(3-chlorophenyl)-1-methyl-
CAS No: 89733-44-8 Catalog No: AG0041SK MDL No:
Product Description
Catalog Number:
AG0041SK
Chemical Name:
1H-Pyrrole-2,5-dione, 3-(3-chlorophenyl)-1-methyl-
CAS Number:
89733-44-8
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
IUPAC Name:
3-(3-chlorophenyl)-1-methylpyrrole-2,5-dione
InChI:
InChI=1S/C11H8ClNO2/c1-13-10(14)6-9(11(13)15)7-3-2-4-8(12)5-7/h2-6H,1H3
InChI Key:
COEGKDWPTUBURI-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C1=CC(=O)N(C1=O)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Inhibition of monoamine oxidase B by N-methyl-2-phenylmaleimides. | Bioorganic & medicinal chemistry 20090415 |
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