7-Methoxy-4,4-dimethyl-3,4-dihydronaphthalen-1(2H)-one
Basic information
- CAS
23203-49-8- Standard SMILES
COc1ccc2c(c1)C(=O)CCC2(C)C- InChIKey
XFUTWROAJKCYDD-UHFFFAOYSA-N- Molecular formula
- C13H16O2
- Average molar mass
- 204.26 g/mol
- Monoisotopic mass
- 204.11502975
Names & identifiers
- Preferred name
- 7-Methoxy-4,4-dimethyl-3,4-dihydronaphthalen-1(2H)-one
- IUPAC
- 7-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one
- English name
- 7-Methoxy-4,4-dimethyl-3,4-dihydro-2H-naphthalen-1-one
- Molecular formula
- C13H16O2
- Molecular weight
- 204.26
Names & synonyms
23203-49-87-METHOXY-4,4-DIMETHYL-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE7-Methoxy-4,4-dimethyl-3,4-dihydronaphthalen-1(2H)-one7-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-one1(2H)-Naphthalenone, 3,4-dihydro-7-methoxy-4,4-dimethyl-NSC245166SCHEMBL2061344SCHEMBL316506341(2H)-Naphthalenone,3,4-dihydro-7-methoxy-4,4-dimethyl-DTXSID00311764XFUTWROAJKCYDD-UHFFFAOYSA-N4,4-dimethyl-7-methoxy-1-tetralone
Show more names
NSC-245166Y13699
Database identifiers
- CAS
23203-49-8- PubChem CID
- 316786
- DTXSID
DTXSID00311764
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 257
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
4 records
Compound notes
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