8-chloro-7-[2-(2-naphthyl)-2-oxoethoxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Basic information
- CAS
405918-51-6- Standard SMILES
O=C(COc1cc2oc(=O)c3c(c2cc1Cl)CCC3)c1ccc2ccccc2c1- InChIKey
QEYHEUMEOZGGCU-UHFFFAOYSA-N- Molecular formula
- C24H17ClO4
- Average molar mass
- 404.8 g/mol
- Monoisotopic mass
- 404.0815367
Names & identifiers
- Preferred name
- 8-chloro-7-[2-(2-naphthyl)-2-oxoethoxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
- IUPAC
- 8-chloro-7-(2-naphthalen-2-yl-2-oxoethoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
- English name
- 8-Cl-7-(2-(2-naphthyl)-2-oxoethoxy)-2,3-dihydrocyclopenta(c)chromen-4(1H)-one
- Molecular formula
- C24H17ClO4
- Molecular weight
- 404.84
Names & synonyms
Oprea1_805280CCG-4698EiM07-13821STL458746AKOS0163695768-chloro-7-[2-(2-naphthyl)-2-oxoethoxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one8-chloro-7-[2-(naphthalen-2-yl)-2-oxoethoxy]-2,3-dihydrocyclopenta[c]chromen-4(1H)-one8-CL-7-(2-(2-NAPHTHYL)-2-OXOETHOXY)-2,3-DIHYDROCYCLOPENTA(C)CHROMEN-4(1H)-ONE8-chloro-7-[2-(naphthalen-2-yl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-oneCyclopenta[c][1]benzopyran-4(1H)-one, 8-chloro-2,3-dihydro-7-[2-(2-naphthalenyl)-2-oxoethoxy]-
Database identifiers
- CAS
405918-51-6- PubChem CID
- 978378
- EC Number
- 143-965-4
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 701
Physicochemical properties
- Boiling point
- 654.929 · 654.929±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.417 · 1.417±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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