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1,1,1-Trichloropropanone

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Name

1,1,1-Trichloropropanone

EINECS 213-063-6
CAS No. 918-00-3 Density 1.475 g/cm3
PSA 17.07000 LogP 1.94560
Solubility N/A Melting Point 9-11℃
Formula C3H3 Cl3 O Boiling Point 134°C
Molecular Weight 161.415 Flash Point 64°C
Transport Information N/A Appearance colorless liquid
Safety Mutation data reported. When heated to decomposition it emits toxic vapors of Cl. Risk Codes 20/21/22-36/37/38
Molecular Structure Molecular Structure of 918-00-3 (1,1,1-TRICHLOROACETONE) Hazard Symbols R25:; R26:; R34:; R50/53:;
Synonyms

1,1,1-Trichloro-2-propanone;1,1,1-Trichloroacetone; 1,1,1-Trichloropropanone; NSC 2645; Trichloromethylmethyl ketone; a,a,a-Trichloroacetone

Article Data 31

1,1,1-Trichloropropanone Synthetic route

76-00-6

1,1,1-trichloropropan-2-ol

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
With sodium dichromate; sulfuric acid In acetic acid for 0.166667h; Ambient temperature;82%
With potassium dichromate; sulfuric acid
With potassium dichromate; sulfuric acid In water
78-95-5

chloroacetone

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
With sodium hydrogencarbonate; sodium chloride In water at 23 - 25℃; Product distribution; current 11 A;82%
With sodium hydrogencarbonate; sodium chloride In water at 23 - 25℃; electrochemical (current 11 A);82%
With chlorine; potassium hydroxide In water at 15 - 20℃; for 6.6h; Reagent/catalyst; Temperature;
513-88-2

1,1-Dichloroacetone

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
With sodium hypochlorite80%
With sodium hydrogencarbonate; sodium chloride Product distribution; electrochemically;65%
With sodium hydrogencarbonate; sodium chloride In water electrochemical;65%
With sodium acetate; chlorine; acetic acid; sodium chloride Reagens 4: Wasser;
6430-25-7

acetyl-triphenylgermane

A

67-72-1

hexachloroethane

B

918-00-3

1,1,1-trichloroacetone

C

1626-24-0

chlorotriphenylgermane

D

75-36-5

acetyl chloride

Conditions
ConditionsYield
With tetrachloromethane In tetrachloromethane Irradiation (UV/VIS); Ph3GeCOMe photolyzed in CCl4;A 53%
B 10%
C 78%
D 74%
16586-14-4

potassium 2,2,2-trichloroacetate

75-36-5

acetyl chloride

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
With perhydrodibenzo-18-crown-6 In acetonitrile for 0.16h;40%
With dibenzo-18-crown-6 In acetonitrile for 0.16h; Product distribution; other reagent; reaction without macrocyclic polyether; other reaction time.;25%

3H,3H-hexachloro-pentane-2,4-dione

furan-2,3,5(4H)-trione pyridine (1:1)

A

918-00-3

1,1,1-trichloroacetone

B

76-03-9

trichloroacetic acid

67-64-1

acetone

918-00-3

1,1,1-trichloroacetone

650-51-1

sodium trichloroacetate

75-36-5

acetyl chloride

918-00-3

1,1,1-trichloroacetone

917-64-6

methyl magnesium iodide

76-02-8

Trichloroacetyl chloride

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
In diethyl ether
76-02-8

Trichloroacetyl chloride

105-53-3

diethyl malonate

918-00-3

1,1,1-trichloroacetone

Conditions
ConditionsYield
(i) EtOH, benzene, (ii) propanoic acid, H2SO4; Multistep reaction;

1,1,1-Trichloropropanone Chemical Properties

IUPAC Name: 1,1,1-Trichloropropan-2-one
The MF of 1,1,1-Trichloropropanone (CAS NO.918-00-3) is C3H3Cl3O.

                                  
The MW of 1,1,1-Trichloropropanone (CAS NO.918-00-3) is 161.41.
Synonyms of 1,1,1-Trichloropropanone (CAS NO.918-00-3): 1,1,1-Trichloroacetone ; 2-Propanone, trichloro- ; 1,1, 1-Trichloro-2-propanone ; 2-Propanone, 1,1,1-trichloro-
Index of Refraction: 1.469 
Density: 1.475 g/ml 
Flash Point: 64.4 °C
Boiling Point: 134.5 °C

1,1,1-Trichloropropanone Uses

  1,1,1-Trichloropropanone (CAS NO.918-00-3) is used as organic intermediates, fine chemicals, pharmaceutical research and development.

1,1,1-Trichloropropanone Toxicity Data With Reference

1.    

mic-bac-sat 359 µg/plate

    MUREAV    Mutation Research. 155 (1985),53.
2.    

cyt-ham-ovr 23 mg/L

    MUREAV    Mutation Research. 206 (1988),431.

1,1,1-Trichloropropanone Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of Cl.Safety information of 1,1,1-Trichloropropanone (CAS NO.918-00-3):
Risk Statements 
20/21/22 Harmful by inhalation, in contact with skin and if swallowed
36/37/38 Irritating to eyes, respiratory system and skin
Safety Statements 
26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37/39 Wear suitable protective clothing, gloves and eye/face protection
RTECS  UC3839000

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