Basic information
- CAS
7499-48-1- Standard SMILES
Cc1ccc2ccc3c4c(c5ccc6ccc(C)cc6c5c3c2c1)C(=O)OC4=O- InChIKey
GPSWASJFFNZWTK-UHFFFAOYSA-N- Molecular formula
- C26H16O3
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.10994437
Names & identifiers
- Preferred name
- 5,23-Dimethyl-14-oxahexacyclo[15.8.0.02,11.03,8.012,16.020,25]pentacosa-1(17),2(11),3(8),4,6,9,12(16),18,20(25),21,23-undecaene-13,15-dione
- IUPAC
- 5,23-dimethyl-14-oxahexacyclo[15.8.0.02,11.03,8.012,16.020,25]pentacosa-1(17),2(11),3(8),4,6,9,12(16),18,20(25),21,23-undecaene-13,15-dione
Names & synonyms
NSC4076617499-48-1DTXSID90324762NSC-40766110,13-Dimethyldibenzo[3,4:5,6]phenanthro[9,10-c]furan-3,5-dione
Database identifiers
- CAS
7499-48-1- PubChem CID
- 348388
- DTXSID
DTXSID90324762
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 642
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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