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Methoxyacetone

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Name

Methoxyacetone

EINECS 227-549-0
CAS No. 5878-19-3 Density 0.898 g/cm3
PSA 26.30000 LogP 0.22180
Solubility Miscible with water Melting Point 78C
Formula C4H8O2 Boiling Point 118.9 °C at 760 mmHg
Molecular Weight 88.1063 Flash Point 25 °C
Transport Information UN 1224 Appearance Clear pale yellow to yellow liquid
Safety 16 Risk Codes 10
Molecular Structure Molecular Structure of 5878-19-3 (Methoxyacetone) Hazard Symbols R10:;
Synonyms

2-Propanone,methoxy- (7CI);1-Methoxy-2-propanone;1-Methoxyacetone;Methoxy-2-propanone;Methoxyacetone;Methoxymethyl methyl ketone;Methyl methoxymethyl ketone;a-Methoxyacetone;a-Methoxypropanone;

Article Data 78

Methoxyacetone Chemical Properties

Structure of 2-Propanone, 1-methoxy- (CAS NO.5878-19-3):

IUPAC Name: 1-methoxypropan-2-one 
Molecular Formula: C4H8O2 
Molecular Weight: 88.10512 
EINECS: 227-549-0 
Melting Point: 78°C 
Boiling Point: 118 °C(lit.)
Density: 0.957 g/mL at 25 °C(lit.)
Water Solubility: miscible 
Classification Code: Skin / Eye Irritant 
Synonyms of 2-Propanone, 1-methoxy- (CAS NO.5878-19-3): 1-Methoxy-2-propanone ; 1-Methoxyacetone ; Methoxy-2-propanone ; Methoxyacetone ; Methoxymethyl methyl ketone
Canonical SMILES: CC(=O)COC
InChI: InChI=1S/C4H8O2/c1-4(5)3-6-2/h3H2,1-2H3
InChIKey: CUZLJOLBIRPEFB-UHFFFAOYSA-N

Methoxyacetone Uses

 2-Propanone, 1-methoxy- (CAS NO.5878-19-3) is used for pesticide intermediates, it can produce Metolachlor.

Methoxyacetone Toxicity Data With Reference

1.    

skn-rbt 500 mg/24H MLD

    85JCAE    Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,704.
2.    

eye-rbt 500 mg/24H MLD

    85JCAE    Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,704.
3.    

orl-rat LD50:8980 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 28 (1974),313.
4.    

skn-rbt LD50:>20 g/kg

    TXAPA9    Toxicology and Applied Pharmacology. 28 (1974),313.

Methoxyacetone Consensus Reports

Reported in EPA TSCA Inventory.

Methoxyacetone Safety Profile

Low toxicity by ingestion and skin contact. A skin and eye irritant. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating vapors.
Hazard Codes: IrritantXi,FlammableF
Risk Statements: 10 
R10:Flammable.
Safety Statements: 16-29-33 
S16:Keep away from sources of ignition. 
S29:Do not empty into drains. 
S33:Take precautionary measures against static discharges.
RIDADR: UN 1224 3/PG 3
WGK Germany: 3
RTECS: UC2988600
HazardClass: 3.2
PackingGroup: III

Methoxyacetone Standards and Recommendations

DOT Classification:  3; Label: Flammable Liquid

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