3-Chloro-5,6-dihydrobenzo[h]chromen-2-one
Basic information
- CAS
55735-31-4- Standard SMILES
O=c1oc2c(cc1Cl)CCc1ccccc1-2- InChIKey
PKQQSNDJQQDUMG-UHFFFAOYSA-N- Molecular formula
- C13H9ClO2
- Average molar mass
- 232.66 g/mol
- Monoisotopic mass
- 232.0291072
Names & identifiers
- Preferred name
- 3-Chloro-5,6-dihydrobenzo[h]chromen-2-one
- IUPAC
- 3-chloro-5,6-dihydrobenzo[h]chromen-2-one
Names & synonyms
55735-31-43-chloro-5,6-dihydrobenzo[h]chromen-2-oneNSC368000DTXSID40321024NSC-3680003-Chloro-5,6-dihydro-2H-naphtho[1,2-b]pyran-2-one
Database identifiers
- CAS
55735-31-4- PubChem CID
- 339850
- DTXSID
DTXSID40321024
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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