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About This Item
Linear Formula:
CH3OC6H4CH2COCH3
CAS Number:
Molecular Weight:
164.20
FEMA Number:
2674
Council of Europe no.:
2047
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
7.087
EC Number:
204-578-7
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
2044332
SMILES string
COc1ccc(CC(C)=O)cc1
InChI
1S/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3
InChI key
WFWKNGZODAOLEO-UHFFFAOYSA-N
biological source
synthetic
grade
Kosher
assay
≥97%
bp
145 °C/25 mmHg (lit.)
density
1.067 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
organoleptic
anise; spicy; fruity; balsamic; sweet
Storage Class
10 - Combustible liquids
wgk
WGK 2
flash_point_f
215.6 °F - closed cup
flash_point_c
102 °C - closed cup
ppe
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
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Hamid Sadeghian et al.
Bioorganic & medicinal chemistry, 17(6), 2327-2335 (2009-03-03)
A group of 4-methoxyphenylacetic acid esters were designed, synthesized and evaluated as potential inhibitors of soybean 15-lipoxygenase (SLO) on the basis of eugenol and esteragol structures. Compounds 7d-e showed the best IC(50) in SLO inhibition (IC(50)=3.8 and 1.9 microM, respectively).
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