Basic information
- CAS
38142-58-4- Standard SMILES
CC(C)=CC(=O)CC(C)c1ccc(C)cc1- InChIKey
NAAJVHHFAXWBOK-UHFFFAOYSA-N- Molecular formula
- C15H20O
- Average molar mass
- 216.32 g/mol
- Monoisotopic mass
- 216.15141526
Overview
(+)-ar-Turmerone is a sesquiterpenoid.
Names & identifiers
- Preferred name
- 2-Methyl-6-(4-methylphenyl)hept-2-en-4-one
- IUPAC
- 2-methyl-6-(4-methylphenyl)hept-2-en-4-one
- English name
- ar-turmerone
- Molecular formula
- C15H20O
- Molecular weight
- 216.32
Names & synonyms
2-methyl-6-(4-methylphenyl)hept-2-en-4-oneRefChem:106376838142-58-4Dl-ar-Turmerone(+/-)-ar-TurmeroneAromatic turmeroneTurmerone, ar-(+/-)-Ar-tumerone(R)-ar-Turmerone2-Hepten-4-one, 2-methyl-6-(4-methylphenyl)-629S5II29P2-Hepten-4-one, 2-methyl-6-(4-methylphenyl)-, (+/-)-
Show more names
ar-turmerone(R)-(-)-ar-Turmerone[R,(-)]-2-Methyl-6-p-tolyl-2-hepten-4-one(R)-2-Methyl-6-(4-methylphenyl)-2-heptene-4-onerac-(6R*)-6-(4-Methylphenyl)-2-methyl-2-heptene-4-one
UNII-629S5II29PTurmerone (-ar)ar-(+/-)-turmerone(S)-2-Methyl-6-(4-methylphenyl)-2-hepten-4-oneUNII-DHL4DBU94ECHEMBL506948SCHEMBL2942390CHEBI:190628
Database identifiers
- CAS
38142-58-4、532-65-0、56485-42-8- PubChem CID
- 558221
- DTXSID
DTXSID701376762
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 253
Experimental & physicochemical properties
Boiling Point325.00 to 326.00 °C. @ 760.00 mm Hg
Physicochemical properties
- Boiling point
- 150 · 150-155 °C(Press: 8 Torr)
- Density
- 0.945 · 0.945±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- FDA UNII
- 629 S5II29P · 629S5II29P
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Applications
Uses(±)-ar-Turmerone is an essential oil extracted from the seeds of Zizyphus jujuba. It is a natural antimicrobial and antioxidant agent.
Upstream & downstream products
Upstream raw materials
Suppliers4 total
北京百奥创新科技有限公司15522676233 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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