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3,4-METHYLENEDIOXYBENZYL ACETONE

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Name

3,4-METHYLENEDIOXYBENZYL ACETONE

EINECS N/A
CAS No. 3160-37-0 Density 1.225g/cm3
PSA 35.53000 LogP 2.01750
Solubility N/A Melting Point 108-110°C
Formula C11H10 O3 Boiling Point 335.1°Cat760mmHg
Molecular Weight 190.199 Flash Point 147.6°C
Transport Information N/A Appearance N/A
Safety Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. Risk Codes N/A
Molecular Structure Molecular Structure of 3160-37-0 (3,4-(METHYLENEDIOXY)BENZYLIDENEACETONE) Hazard Symbols N/A
Synonyms

3-Buten-2-one,4-[3,4-(methylenedioxy)phenyl]- (6CI,7CI,8CI);3,4-(Methylenedioxy)benzalacetone; 4-(3,4-Methylenedioxyphenyl)-3-buten-2-one;5-(3-Oxo-1-butenyl)-1,3-benzodioxole; Heliotropyl acetone; NSC 217304; NSC407384; Piperonalacetone; Piperonylideneacetone

Article Data 17

3,4-METHYLENEDIOXYBENZYL ACETONE Chemical Properties

MF: C11H10O3
MW: 190.2
EINECS: 221-608-4
Density: 1.225 g/cm3 
Flash Point: 147.6 °C 
Melting Point: 108-110°C
Index of Refraction: 1.598 
Appearance: Clear yellow liquid.
Solubility: Insoluble in water.
Enthalpy of Vaporization: 57.81 kJ/mol 
Boiling Point: 335.1 °C at 760 mmHg 
Vapour Pressure: 0.000123 mmHg at 25°C 
IUPAC Name: (Z)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one
Synonyms: 3,4-(Methylenedioxy)benzalacetone ; 4-(1,3-Benzodioxol-5-yl)-3-buten-2-one ; 4-(3,4-(Methylenedioxy)phenyl)-3-buten-2-one ; Piperonalacetone ; Piperonylidene-aceton
Following is the molecular structure of 3,4-Methylenedioxybenzal acetone (CAS NO.3160-37-0):

3,4-METHYLENEDIOXYBENZYL ACETONE Production

Reactivity Profile: 3,4-Methylenedioxybenzal acetone (CAS NO.3160-37-0)is a ketone. Ketones are reactive with many acids and bases liberating heat and flammable gases (e.g., H2). The amount of heat may be sufficient to start a fire in the unreacted portion of the ketone. Ketones react with reducing agents such as hydrides, alkali metals, and nitrides to produce flammable gas (H2) and heat. Ketones are incompatible with isocyanates, aldehydes, cyanides, peroxides, and anhydrides. They react violently with aldehydes, HNO3, HNO3 + H2O2, and HClO4.

 

3,4-METHYLENEDIOXYBENZYL ACETONE Toxicity Data With Reference

1.    

orl-rat LD50:4 g/kg

    FCTXAV    Food and Cosmetics Toxicology. 14 (1976),659.
Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 41, 1978.
rat LD50 oral 4gm/kg (4000mg/kg)   Food and Cosmetics Toxicology. Vol. 14, Pg. 847, 1976.

3,4-METHYLENEDIOXYBENZYL ACETONE Consensus Reports

Reported in EPA TSCA Inventory.

3,4-METHYLENEDIOXYBENZYL ACETONE Safety Profile

Low toxicity by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes.
Safety Information of 3,4-Methylenedioxybenzal acetone (CAS NO.3160-37-0):
Safety Statements: 22-24/25
 S22: Do not breathe dust. 
S24/25: Avoid contact with skin and eyes.
RTECS: EM9822500