Basic information
- CAS
81534-84-1- Standard SMILES
CCc1nc2c(Br)c3oc(CC)nc3c(Br)c2o1- InChIKey
NBHLYWOOUMGDRC-UHFFFAOYSA-N- Molecular formula
- C12H10Br2N2O2
- Average molar mass
- 374.03 g/mol
- Monoisotopic mass
- 371.9109
Names & identifiers
- Preferred name
- 4,8-Dibromo-2,6-diethyl-[1,3]oxazolo[5,4-f][1,3]benzoxazole
- IUPAC
- 4,8-dibromo-2,6-diethyl-[1,3]oxazolo[5,4-f][1,3]benzoxazole
Names & synonyms
81534-84-14,8-dibromo-2,6-diethyl-[1,3]oxazolo[5,4-f][1,3]benzoxazoleNSC365094DTXSID50320826NSC-3650944,8-Dibromo-2,6-diethylbenzo[1,2-d:4,5-d']bis[1,3]oxazole
Database identifiers
- CAS
81534-84-1- PubChem CID
- 339262
- DTXSID
DTXSID50320826- Nikkaji
- J3.230.399D
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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