Basic information
- CAS
78259-41-3- Standard SMILES
C/C=C\c1ccc(OCC=C(C)C)cc1- InChIKey
JGELFJUQMIUNOO-PLNGDYQASA-N- Molecular formula
- C14H18O
- Average molar mass
- 202.29 g/mol
- Monoisotopic mass
- 202.13576519
Overview
Feniculin is an aromatic ether.
Names & identifiers
- Preferred name
- Feniculin
- IUPAC
- 1-(3-methylbut-2-enoxy)-4-[(Z)-prop-1-enyl]benzene
- English name
- Foeniculin (4 x 50 mg)
- Molecular formula
- C14H18O
- Molecular weight
- 202.29
Names & synonyms
Feniculin1-(3-methylbut-2-enoxy)-4-[(Z)-prop-1-enyl]benzene1-(3-methylbut-2-enoxy)-4-((Z)-prop-1-enyl)benzeneRefChem:140156JGELFJUQMIUNOO-PLNGDYQASA-NCHEBI:168725Foeniculin, (E)-Foeniculin (4 x 50 mg)(E)-1-((3-Methylbut-2-en-1-yl)oxy)-4-(prop-1-en-1-yl)benzeneBenzene, 1-[(3-methyl-2-buten-1-yl)oxy]-4-(1E)-1-propen-1-yl-
Database identifiers
- CAS
78259-41-3- PubChem CID
- 91746961
- ChEBI
CHEBI:168725- Nikkaji
- J1.444.044E
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 215
Experimental & physicochemical properties
Melting Point23.5 - 24.5 °C
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 313.7 · 313.7±11.0 °C(Predicted)
- Density
- 0.945 · 0.945±0.06 g/cm3(Predicted)
- Odor
- withering foliage green
- LogP
- 4.842 · 4.842 (est)
- FDA UNII
- 3391 G00A · QO3391G00A
- HS Code
- 2909300000 · 2909300000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2909300000
Chemistry & industry
Pharmacology
Cellular LocationsMembrane
Applications
UsesFoeniculin is a compound within Illicium verum essential oil, which is also known as Star Anise.
Suppliers4 total
泰迩生物医药泰州有限公司052386810091 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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