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Safety Information

W354805

Sigma-Aldrich

2′-Hydroxyacetophenone

≥98%

Synonym(s):

2-Acetylphenol

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About This Item

Linear Formula:
HOC6H4COCH3
CAS Number:
118-93-4
Molecular Weight:
136.15
FEMA Number:
3548
Beilstein:
386123
EC Number:
204-288-0
Council of Europe no.:
4136
MDL number:
MFCD00002219
UNSPSC Code:
12164502
PubChem Substance ID:
24901776
Flavis number:
7.124
NACRES:
NA.21

biological source

synthetic

grade

Fragrance grade

Agency

follows IFRA guidelines
meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009

vapor density

4.7 (vs air)

vapor pressure

~0.2 mmHg ( 20 °C)

Assay

≥98%

refractive index

n20/D 1.558 (lit.)

bp

213 °C/717 mmHg (lit.)

mp

3-6 °C (lit.)

density

1.133 g/mL at 20 °C
1.131 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

Organoleptic

hawthorne; herbaceous; phenolic; sweet

SMILES string

CC(=O)c1ccccc1O

InChI

1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3

InChI key

JECYUBVRTQDVAT-UHFFFAOYSA-N

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Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

222.8 °F - closed cup

Flash Point(C)

106 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

W354805-SAMPLE:
W354805-1KG:4548173978857
W354805-VAR:
W354805-BULK:
W354805-10KG:
W354805-5KG:4548173978864

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Certificates of Analysis (COA)

Lot/Batch Number
SHBN5165
SHBM1119
MKCH0115
MKCD2747
STBG0267V

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Shuai Chen et al.
Organic letters, 14(11), 2806-2809 (2012-05-17)
Flavin catalysts perform the first organocatalytic Dakin oxidation of electron-rich arylaldehydes to phenols under mild, basic conditions. Catechols are readily prepared, and the oxidation of 2-hydroxyacetophenone was achieved. Aerobic oxidation is displayed in the presence of Zn(0) as a reducing
José I Borrell et al.
Molecular diversity, 8(2), 147-157 (2004-06-24)
Two new solid-phase syntheses of substituted pyrazoles are described. The first includes supporting an o-hydroxyacetophenone on Merrifield resin, Vilsmeier-Haack formylation on the methyl group and cyclization with a substituted hydrazine to afford a pyrazole ring with two diversity centers. The
Synthesis and pharmacological evaluation of some potential beta-adrenolytics derivated from o-hydroxyacetophenone.
R Cizmáriková et al.
Die Pharmazie, 49(5), 366-367 (1994-05-01)
Rohith P John et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 59(6), 1349-1358 (2003-03-28)
The spectral studies and structure of a ternary complex of copper(II) with 2-hydroxyacetophenone 3-hexamethyliminylthiosemicarbazonate (L(2-)) and 1,10-phenanthroline (phen) are reported. The thiosemicarbazone binds to the metal as a dianionic ONS-donor (L(2-)) ligand, and forms a complex of the stoichiometry [CuLphen].
R R Zaky et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 97, 683-694 (2012-08-14)
The o-Hydroxy acetophenone [N-(3-hydroxy-2-naphthoyl)] hydrazone (H(2)o-HAHNH) has been prepared and its structure is confirmed by elemental analysis, IR, (1)H NMR and (13)C NMR spectroscopy. It has been used to produce diverse complexes with Co(II), Cd(II), Hg(II) and U(VI)O(2) ions. The
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