7-(4-Bromobenzoyl)-3,3-dibromo-1,3-dihydro-2H-indol-2-one - CAS 1797880-03-5
Catalog: |
BB072338 |
Product Name: |
7-(4-Bromobenzoyl)-3,3-dibromo-1,3-dihydro-2H-indol-2-one |
CAS: |
1797880-03-5 |
Synonyms: |
3,3-Dibromo-7-(4-bromobenzoyl)-1H-indol-2-one; 7-(4-Bromobenzoyl)-3,3-dibromo-1,3-dihydro-2H-indol-2-one; 3,3-Dibromo-7-(4-bromobenzoyl)indolin-2-one |
IUPAC Name: | 3,3-dibromo-7-(4-bromobenzoyl)-1H-indol-2-one |
Molecular Weight: | 473.94 |
Molecular Formula: | C15H8Br3NO2 |
Canonical SMILES: | C1=CC(=C2C(=C1)C(C(=O)N2)(Br)Br)C(=O)C3=CC=C(C=C3)Br |
InChI: | InChI=1S/C15H8Br3NO2/c16-9-6-4-8(5-7-9)13(20)10-2-1-3-11-12(10)19-14(21)15(11,17)18/h1-7H,(H,19,21) |
InChI Key: | YLJLRBQUPXLALR-UHFFFAOYSA-N |
Solubility: | Chloroform, Ethyl Acetate |
Appearance: | White Solid |
Complexity: | 446 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 472.80847 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 470.81052 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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