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1146-98-1 | 1H-Indene-1,3(2H)-dione, 2-(4-bromophenyl)-
CAS No: 1146-98-1 Catalog No: AG000ESQ MDL No:
Product Description
Catalog Number:
AG000ESQ
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(4-bromophenyl)-
CAS Number:
1146-98-1
Molecular Formula:
C15H9BrO2
Molecular Weight:
301.1348
IUPAC Name:
2-(4-bromophenyl)indene-1,3-dione
InChI:
InChI=1S/C15H9BrO2/c16-10-7-5-9(6-8-10)13-14(17)11-3-1-2-4-12(11)15(13)18/h1-8,13H
InChI Key:
NPUZIGSOEWMFKK-UHFFFAOYSA-N
SMILES:
O=C1C(c2ccc(cc2)Br)C(=O)c2c1cccc2
UNII:
OQZ7BND2QN
NSC Number:
759118
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.979g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.139g/mol
Monoisotopic Mass:
299.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| FDA-approved drugs and other compounds tested as inhibitors of human glutathione transferase P1-1. | Chemico-biological interactions 20130905 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Hypolipidemic activity of indan-1,3-dione derivatives in rodents. | Journal of medicinal chemistry 19851101 |
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