3′,5′-Dimethoxyacetophenone

Modify Date: 2025-08-20 22:46:16

3′,5′-Dimethoxyacetophenone Structure
3′,5′-Dimethoxyacetophenone structure
Common Name 3′,5′-Dimethoxyacetophenone
CAS Number 39151-19-4 Molecular Weight 180.201
Density 1.1±0.1 g/cm3 Boiling Point 290.5±0.0 °C at 760 mmHg
Molecular Formula C10H12O3 Melting Point 33-34 °C(lit.)
MSDS Chinese USA Flash Point 109.0±8.2 °C

 Use of 3′,5′-Dimethoxyacetophenone


3′,5′-Dimethoxyacetophenone is a natural ketone compound with antioxidant activities. 3′,5′-Dimethoxyacetophenone is a building block in the chemical synthesis[1].

 Names

Name 3',5'-Dimethoxyacetophenone
Synonym More Synonyms

 3′,5′-Dimethoxyacetophenone Biological Activity

Description 3′,5′-Dimethoxyacetophenone is a natural ketone compound with antioxidant activities. 3′,5′-Dimethoxyacetophenone is a building block in the chemical synthesis[1].
Related Catalog
References

[1]. Salem S Alghamdi, et al. Comparative phytochemical profiling of different soybean ( Glycine max (L.) Merr) genotypes using GC-MS. Saudi J Biol Sci. 2018 Jan;25(1):15-21.

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 290.5±0.0 °C at 760 mmHg
Melting Point 33-34 °C(lit.)
Molecular Formula C10H12O3
Molecular Weight 180.201
Flash Point 109.0±8.2 °C
Exact Mass 180.078644
PSA 35.53000
LogP 1.90
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.499
InChIKey YJKHOUIVWKQRSL-UHFFFAOYSA-N
SMILES COc1cc(OC)cc(C(C)=O)c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5775717
CHEMICAL NAME :
Ethanone, 1-(3,5-dimethoxyphenyl)-
CAS REGISTRY NUMBER :
39151-19-4
LAST UPDATED :
199703
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-O3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #95-206642

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xi
Safety Phrases S24/25
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS KM5775717
HS Code 2914509090

 Synthetic Route

 Customs

HS Code 2914509090
Summary HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Articles2

More Articles
5, 7-Dimethoxy-3-Methylindazole from 3, 5-Dimethoxyacetophenone. Boudreault N and Leblanc Y.

Organic Synth. , 241

Stereochemistry of photosolvolysis of a chiral, 18O-labeled 1-arylethyl acetate. Jaeger DA and Angelos GH

Tetrahedron Lett. 22(9) , 803-806, (1981)

 3′,5′-DimethoxyacetophenoneBioassay

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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Flow Cytometric HTS Screen for inhibitors of the ABC transporter ABCB6 for Validation...
Source: NMMLSC
Target: ATP-binding cassette sub-family B member 6, mitochondrial [Homo sapiens]
External Id: UNMCMD_ABCB6_1o_ValidationSet
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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 Synonyms

1-(3,5-Dimethoxyphenyl)ethanone
EINECS 254-322-3
MFCD00008739
3,5-Dimethoxyacetophenone
3′,5′-Dimethoxyacetophenone
Acetosyringenin
3‘,5‘-Dimethoxyacetophenone
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