Basic information
- CAS
7469-74-1- Standard SMILES
CCC1(C(=O)OC)CCc2ccccc2C1=O- InChIKey
MCTSXXIDKJVVPW-UHFFFAOYSA-N- Molecular formula
- C14H16O3
- Average molar mass
- 232.27 g/mol
- Monoisotopic mass
- 232.10994437
Names & identifiers
- Preferred name
- Methyl 2-ethyl-1-oxo-3,4-dihydronaphthalene-2-carboxylate
- IUPAC
- methyl 2-ethyl-1-oxo-3,4-dihydronaphthalene-2-carboxylate
Names & synonyms
7469-74-1methyl 2-ethyl-1-oxo-3,4-dihydronaphthalene-2-carboxylateNSC402205DTXSID00322870NSC-402205Methyl 2-ethyl-1-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylate
Database identifiers
- CAS
7469-74-1- PubChem CID
- 345005
- DTXSID
DTXSID00322870
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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