1,8-dibromo-9,10-Anthracenedione - CAS 38313-16-5
Catalog: |
BB061763 |
Product Name: |
1,8-dibromo-9,10-Anthracenedione |
CAS: |
38313-16-5 |
Synonyms: |
1,8-dibromoanthraquinone; 1,8-dibromoanthracene-9,10-dione; 1,8-Dibromo-9,10-anthraquinone; 1,8-dibromo-9,10-Anthracenedione |
IUPAC Name: | 1,8-dibromoanthracene-9,10-dione |
Molecular Weight: | 366 |
Molecular Formula: | C14H6Br2O2 |
Canonical SMILES: | C1=CC2=C(C(=C1)Br)C(=O)C3=C(C2=O)C=CC=C3Br |
InChI: | InChI=1S/C14H6Br2O2/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6H |
InChI Key: | QIFCTRBXWWHIFG-UHFFFAOYSA-N |
Complexity: | 350 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 365.87141 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 363.87345 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 34.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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