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4'-Methoxyacetophenone

4'-Methoxyacetophenone Structure
CAS No.
100-06-1
Chemical Name:
4'-Methoxyacetophenone
Synonyms
4-METHOXYACETOPHENONE;ACETANISOLE;1-(4-METHOXYPHENYL)ETHANONE;4-ACETYLANISOLE;P-ACETYLANISOLE;Acetanisol;P-METHOXYACETOPHENONE;Ethanone, 1-(4-methoxyphenyl)-;Vananote;p-Acetoanisole
CBNumber:
CB1132155
Molecular Formula:
C9H10O2
Molecular Weight:
150.17
MOL File:
100-06-1.mol
MSDS File:
SDS
Modify Date:
2024/7/10 17:45:06

4'-Methoxyacetophenone Properties

Melting point 36-38 °C (lit.)
Boiling point 152-154 °C/26 mmHg (lit.)
Density 1.08
vapor pressure 0.42Pa at 20℃
refractive index 1.5470 (estimate)
FEMA 2005 | ACETANISOLE
Flash point >230 °F
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility H2O: soluble2.474g/L at 20°C
form Crystals or Crystalline Powder
color White
Odor at 100.00 %. sweet hawthorn anisic powdery balsamic acacia
Odor Type anisic
Water Solubility insoluble
Sensitive Light Sensitive
JECFA Number 810
BRN 742313
InChIKey NTPLXRHDUXRPNE-UHFFFAOYSA-N
LogP 1.79 at 20℃
CAS DataBase Reference 100-06-1(CAS DataBase Reference)
NIST Chemistry Reference Acetophenone, 4'-methoxy-(100-06-1)
EPA Substance Registry System 4'-Methoxyacetophenone (100-06-1)

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312-P501
Hazard Codes  Xn
Risk Statements  22-38-36/38-20/21/22
Safety Statements  37-37/39-26-36
WGK Germany  2
RTECS  AM9240000
TSCA  Yes
HS Code  29145000
Toxicity The acute oral LD50 value in rats was reported as 1.72 g/kg (1.47-1.97 g/kg) (Moreno, 1973). The acute dermal LD50 value in rabbits was reported as > 5 g/kg (Moreno, 1973).
NFPA 704
0
1 0

4'-Methoxyacetophenone price More Price(16)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich(India) W200506 Acetanisole ≥98%, FCC, FG 100-06-1 1SAMPLE-K ₹5141.88 2022-06-14 Buy
Sigma-Aldrich(India) W200506 Acetanisole ≥98%, FCC, FG 100-06-1 1KG ₹13195.68 2022-06-14 Buy
Sigma-Aldrich(India) W200506 Acetanisole ≥98%, FCC, FG 100-06-1 5KG ₹45724.8 2022-06-14 Buy
Sigma-Aldrich(India) W200506 Acetanisole ≥98%, FCC, FG 100-06-1 25KG ₹165849.83 2022-06-14 Buy
Sigma-Aldrich(India) 117374 4′-Methoxyacetophenone 99% 100-06-1 5G ₹3110 2022-06-14 Buy
Product number Packaging Price Buy
W200506 1SAMPLE-K ₹5141.88 Buy
W200506 1KG ₹13195.68 Buy
W200506 5KG ₹45724.8 Buy
W200506 25KG ₹165849.83 Buy
117374 5G ₹3110 Buy

4'-Methoxyacetophenone Chemical Properties,Uses,Production

Chemical Properties

WHITE CRYSTALS OR CRYSTALLINE POWDER

Chemical Properties

Colorless crystals or fused crystalline/Yellowish-white crystals mass. with an odor similar to that of p-methylacetopheneone, suggestive of hawthorn and floral note of heliotrope, possessing a bitter and unpleasant taste. Useful in vanilla, nut, tobacco and butter flavors. Heavier than water, practically insoluble in water. Miscible with oils, soluble in alcohol, Relatively stable in soap and under similar, mild-alkaline conditions.

Occurrence

Reported found in European cranberry (Vaccinium oxycoccus L.), guava fruit (Psidium guajava L.), Vitis labrusca L., tomato, anise (Pimpinella anisum L.), mentha oils, grilled and roasted beef, sherry, cloudberry (Rubus chamaemorus L.), salted and pickled plums, Illicium verum and black chokeberry (Aronia melanocarpa ell.).

Uses

4'-Methoxyacetophenone is a solid, pale yellow flavoring agent with a hawthornlike odor. It is soluble in most fixed oils and propylene glycol, and it is insoluble in glycerin and mineral oil. It is obtained by chemical synthesis. This flavoring substance or its adjuvant may be safely used in food in the minimum quantity required to produce its intended flavor. It can be used alone or in combination with other flavoring substances or adjuvants. It is also termed p-methoxyacetophenone.

Preparation

From anisole and acetyl chloride in the presence of aluminum chloride and carbon disulfide; from anisole and acetic acid in the presence of boron trifluoride.

Definition

ChEBI: A member of the class of acetophenones that is acetophenone substituted by a methoxy group at position 4.

General Description

4′-Methoxyacetophenone undergoes biocatalytic enantioselective reduction using immobilized Rhodotorula sp. AS2.2241 cells to yield (S)-1-(4-methoxyphenyl) ethanol in a hydrophilic ionic liquid-containing co-solvent system.

Safety Profile

Moderately toxic by ingestion. Human systemic effects by inhalation: pulse rate increase without fall in blood pressure and blood pressure elevation. A skin irritant. Flammable liquid. When heated to decomposition it emits acrid smoke and irritating fumes. See also KETONES.

Purification Methods

Crystallise the ketone from diethyl ether/pet ether. [Beilstein 8 IV 340.]

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