6-Methoxy-1,1-dimethyl-3,4-dihydronaphthalen-2-one
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Basic information
- CAS
71886-83-4- Standard SMILES
COc1ccc2c(c1)CCC(=O)C2(C)C- InChIKey
TWUWJSIJBYYXEO-UHFFFAOYSA-N- Molecular formula
- C13H16O2
- Average molar mass
- 204.26 g/mol
Names & identifiers
- Preferred name
- 6-Methoxy-1,1-dimethyl-3,4-dihydronaphthalen-2-one
- IUPAC
- 6-methoxy-1,1-dimethyl-3,4-dihydronaphthalen-2-one
- English name
- 6-methoxy-1,1-dimethyl-3,4-dihydronaphthalen-2(1H)-one
- Molecular formula
- C13H16O2
- Molecular weight
- 204.26
Names & synonyms
71886-83-46-methoxy-1,1-dimethyl-3,4-dihydronaphthalen-2-one6-METHOXY-1,1-DIMETHYL-3,4-DIHYDRONAPHTHALEN-2(1H)-ONESCHEMBL227927TWUWJSIJBYYXEO-UHFFFAOYSA-NMFCD26640946AT15304DA-24710SY3660746-Methoxy-1,1-dimethyl-3,4-dihydro-1H-naphthalen-2-one3,4-dihydro-6-methoxy-1,1-dimethylnaphthalen-2(1H)-one2(1H)-Naphthalenone, 3,4-dihydro-6-methoxy-1,1-dimethyl-
Database identifiers
- CAS
71886-83-4
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- 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
Physicochemical properties
- Boiling point
- 108 · 108-113 °C(Press: 0.5-0.6 Torr)
- Density
- 1.046 · 1.046±0.06 g/cm3(Predicted)
Related reactions
0 records
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Compound notes
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