3-(4-Bromonaphthalen-1-yl)chromen-2-one
Basic information
- CAS
59776-62-4- Standard SMILES
O=c1oc2ccccc2cc1-c1ccc(Br)c2ccccc12- InChIKey
IKQIEWORVRQNHB-UHFFFAOYSA-N- Molecular formula
- C19H11BrO2
- Average molar mass
- 351.2 g/mol
- Monoisotopic mass
- 349.99424
Names & identifiers
- Preferred name
- 3-(4-Bromonaphthalen-1-yl)chromen-2-one
- IUPAC
- 3-(4-bromonaphthalen-1-yl)chromen-2-one
Names & synonyms
59776-62-4NSC 2817183-(4-bromonaphthalen-1-yl)chromen-2-oneNSC281718DTXSID20314252NSC-281718DS-0040903-(4-Bromonaphthalen-1-yl)-2H-1-benzopyran-2-one2H-1-BENZOPYRAN-2-ONE,3-(4-BROMO-1-NAPHTHALENYL)-
Database identifiers
- CAS
59776-62-4- PubChem CID
- 323003
- DTXSID
DTXSID20314252
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 472
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…