Basic information
- CAS
16984-77-3- Standard SMILES
O=C(c1cc2cc(Br)ccc2oc1=O)c1cc2cc(Br)ccc2oc1=O- InChIKey
KYYJWROODXGFKW-UHFFFAOYSA-N- Molecular formula
- C19H8Br2O5
- Average molar mass
- 476.1 g/mol
- Monoisotopic mass
- 473.87385
Names & identifiers
- Preferred name
- 2h-1-Benzopyran-2-one, 3,3'-carbonylbis[6-bromo-
- IUPAC
- 6-bromo-3-(6-bromo-2-oxochromene-3-carbonyl)chromen-2-one
Names & synonyms
16984-77-33,3'-carbonylbis(6-bromo-2H-chromen-2-one)2h-1-benzopyran-2-one, 3,3'-carbonylbis[6-bromo-NSC133802SCHEMBL1367953DTXSID20299934STK662629AKOS003279076NSC-133802DS-0040922H-1-benzopyran-2-one,3,3-carbonylbis[6-bromo-3,3'-Carbonylbis(6-bromo-2H-1-benzopyran-2-one)
Database identifiers
- CAS
16984-77-3- PubChem CID
- 281187
- DTXSID
DTXSID20299934
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 655
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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