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274801

Sigma-Aldrich

3′,4′-(Methylenedioxy)acetophenone

98%

Synonym(s):

1-(1,3-Benzodioxol-5-yl)ethanone, 1-(1,3-Dioxaindan-5-yl)ethan-1-one, 1-(Benz[d][1,3]dioxol-5-yl)ethanone, 1-(Benzo[d][1,3]dioxol-5-yl)ethanone, 1-(Benzodioxol-5-yl)ethanone, 1-Acetyl-3,4-(methylenedioxy)benzene, 3,4-(Methylenedioxy)phenyl methyl ketone, 5-Acetyl-1,3-benzodioxole

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About This Item

Empirical Formula (Hill Notation):
C9H8O3
CAS Number:
3162-29-6
Molecular Weight:
164.16
EC Number:
221-613-1
MDL number:
MFCD00005831
UNSPSC Code:
12352100
PubChem Substance ID:
24856606
NACRES:
NA.22

Quality Level

100

Assay

98%

form

solid

mp

87-89 °C (lit.)

SMILES string

CC(=O)c1ccc2OCOc2c1

InChI

1S/C9H8O3/c1-6(10)7-2-3-8-9(4-7)12-5-11-8/h2-4H,5H2,1H3

InChI key

BMHMKWXYXFBWMI-UHFFFAOYSA-N

Application

3′,4′-(Methylenedioxy)acetophenone was used in the synthesis of N-ethyl-1-(3,4-methylenedioxyphenyl)ethylamine.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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C Marson et al.
Journal of analytical toxicology, 24(1), 17-21 (2000-02-02)
The present paper describes investigations following the analysis of a urine specimen containing important amounts of an unknown substance detected by gas chromatography-mass spectrometry (GC-MS) analysis. FPIA analysis was positive (cutoff 0.3 mg/L) and Triage 8 rapid test was negative

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