Basic information
- CAS
84412-11-3- Standard SMILES
O=Cc1cc2c3c(cccc3c1)CC2- InChIKey
CXOYJCOONOHMJI-UHFFFAOYSA-N- Molecular formula
- C13H10O
- Average molar mass
- 182.22 g/mol
- Monoisotopic mass
- 182.07316494
Names & identifiers
- Preferred name
- 1,2-Dihydroacenaphthylenecarboxaldehyde
- IUPAC
- 1,2-dihydroacenaphthylene-4-carbaldehyde
Names & synonyms
1,2-DIHYDROACENAPHTHYLENECARBOXALDEHYDE84412-11-31,2-dihydroacenaphthylene-4-carbaldehydeSCHEMBL15607320DTXSID90233380
Database identifiers
- CAS
84412-11-3- PubChem CID
- 55258
- DTXSID
DTXSID90233380
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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