Basic information
- CAS
67717-72-0- Standard SMILES
O=c1oc2ccccc2c2c1Cc1c(oc3ccc4ccccc4c3c1=O)O2- InChIKey
XOWMMJHWRVUNCJ-UHFFFAOYSA-N- Molecular formula
- C23H12O5
- Average molar mass
- 368.3 g/mol
- Monoisotopic mass
- 368.06847348
Names & identifiers
- Preferred name
- 2,10,26-Trioxahexacyclo[12.12.0.03,12.04,9.016,25.017,22]hexacosa-1(14),3(12),4,6,8,16(25),17,19,21,23-decaene-11,15-dione
- IUPAC
- 2,10,26-trioxahexacyclo[12.12.0.03,12.04,9.016,25.017,22]hexacosa-1(14),3(12),4,6,8,16(25),17,19,21,23-decaene-11,15-dione
Names & synonyms
NSC32095667717-72-0DTXSID10317813NSC-3209566H,7H,8H-Naphtho[1'',2'':5',6']pyrano[3',2':5,6]pyrano[3,2-c][1]benzopyran-6,8-dione
Database identifiers
- CAS
67717-72-0- PubChem CID
- 330976
- DTXSID
DTXSID10317813
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 793
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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