Anthra[10,4-cd:9,8-c'd']bis[1,2]oxazole
Basic information
- CAS
201-88-7- Standard SMILES
c1cc2onc3c4cccc5onc(c(c1)c23)c54- InChIKey
VRQGMACYSHACCO-UHFFFAOYSA-N- Molecular formula
- C14H6N2O2
- Average molar mass
- 234.21 g/mol
- Monoisotopic mass
- 234.04292744
Names & identifiers
- Preferred name
- Anthra[10,4-cd:9,8-c'd']bis[1,2]oxazole
- IUPAC
- 4,12-dioxa-3,11-diazapentacyclo[8.6.1.12,5.013,17.09,18]octadeca-1(17),2,5,7,9(18),10,13,15-octaene
Names & synonyms
201-88-7NSC382810anthra[10,4-cd:9,8-c'd']bis[1,2]oxazoleDTXSID20321885NSC-382810
Database identifiers
- CAS
201-88-7- PubChem CID
- 343386
- DTXSID
DTXSID20321885
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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