1,1,1-Trichloropropanone supplier

Name
1,1,1-TRICHLOROACETONE
EINECS 213-063-6
CAS No. 918-00-3
Article Data31
CAS DataBase
Density 1.475 g/cm³
Solubility
Melting Point 9-11℃
Formula C3H3 Cl3 O
Boiling Point 134°C
Molecular Weight 161.415
Flash Point 64°C
Transport Information
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
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
PSA 17.07000
LogP 1.94560

Synthetic route

: 76-00-6
1,1,1-trichloropropan-2-ol

: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
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

Conditions	Yield
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

Conditions	Yield
With sodium hypochlorite	80%
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

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

...Expand

: 16586-14-4
potassium 2,2,2-trichloroacetate

: 75-36-5
acetyl chloride

: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
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

...Expand

: 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

Conditions	Yield
In diethyl ether

: 76-02-8
Trichloroacetyl chloride

: 105-53-3
diethyl malonate

: 918-00-3
1,1,1-trichloroacetone

Conditions

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

: 56-23-5
tetrachloromethane

: 86310-10-3
5,5-dicyclopropyl-2-methoxy-2-methyl-Δ3-1,3,4-oxadiazoline

A: 67-66-3
chloroform

B: 79-20-9
acetic acid methyl ester

C: 918-00-3
1,1,1-trichloroacetone

D: 86310-12-5
1,4-dichloro-1-cyclopropylbut-1-ene

E: 86310-11-4
1,1,1,2-tetrachloro-2,2-dicyclopropylethane

F: 86310-13-6
(Z)-1,4,7-Trichloro-5-trichloromethyl-hept-3-ene

Conditions

Conditions	Yield
Mechanism; Heating;	A 10 % Chromat. B 88 % Chromat. C 3 % Chromat. D 7 % Chromat. E n/a F 26 % Chromat.

...Expand

: 56-23-5
tetrachloromethane

: 431-03-8
dimethylglyoxal

A: 918-00-3
1,1,1-trichloroacetone

B: 73623-81-1
butane-2,3-dione (enol form)

C: 75-36-5
acetyl chloride

D: 67-64-1
acetone

Conditions

Conditions	Yield
In various solvent(s) Product distribution; Irradiation;

...Expand

: 67-64-1
acetone

A: 513-88-2
1,1-Dichloroacetone

B: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
With chlorine In N,N-dimethyl-formamide at 50℃; for 2h; Product distribution; other chlorination agent;	A 95 % Chromat. B 5 % Chromat.

: C4H6Cl3O

A: 2229-07-4
methyl radical

B: 3170-80-7
trichloromethyl radical

C: 918-00-3
1,1,1-trichloroacetone

D: 67-64-1
acetone

Conditions

Conditions	Yield
In tetrachloromethane Rate constant; Heating;

...Expand

: 7782-50-5
chlorine

: 78-95-5
chloroacetone

A: 921-03-9
1,1,3-trichloroacetone

B: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
at 30 - 40℃;

...Expand

2.4.4-trimethyl-2-trichloromethyl-1.3-dioxolone-(5): 2.4.4-trimethyl-2-trichloromethyl-1.3-dioxolone-(5)

: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
With hydrogenchloride; acetic acid Hydrolysis;

: 513-88-2
1,1-Dichloroacetone

: 7782-50-5
chlorine

A: 921-03-9
1,1,3-trichloroacetone

B: 918-00-3
1,1,1-trichloroacetone

...Expand

: 498-23-7
citraconic acid

: 7732-18-5
water

: 7782-50-5
chlorine

A: 6625-00-9
β-chloromethacrylic acid

B: 918-00-3
1,1,1-trichloroacetone

C: 10027-62-0
α,β,β-trichloro-isobutyric acid

D: 3-chloro-2-hydroxy-2-methyl-succinic acid

Conditions

Conditions	Yield
citraconsaeures Natrium reagiert;

...Expand

: 18815-73-1
methylzinc iodide

: 76-02-8
Trichloroacetyl chloride

A: 918-00-3
1,1,1-trichloroacetone

B trichloroacetic acid-<β.β.β-trichloro-tert-butyl ester>: trichloroacetic acid-<β.β.β-trichloro-tert-butyl ester>

...Expand

: 513-88-2
1,1-Dichloroacetone

A: 116-16-5
1,1,1,3,3,3-hexachloro-propan-2-one

B: 918-00-3
1,1,1-trichloroacetone

C: 1768-31-6
pentachloroacetone

Conditions

Conditions	Yield
With pyridine; chlorine at 70 - 80℃; for 4h;

...Expand

: 78-95-5
chloroacetone

A: 116-16-5
1,1,1,3,3,3-hexachloro-propan-2-one

B: 918-00-3
1,1,1-trichloroacetone

C: 1768-31-6
pentachloroacetone

Conditions

Conditions	Yield
With pyridine; chlorine at 70 - 80℃; for 7.75h;

...Expand

: 67-64-1
acetone

A: 513-88-2
1,1-Dichloroacetone

B: 921-03-9
1,1,3-trichloroacetone

C: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
With hydrogenchloride; chlorine at 20 - 80℃; for 8.5h;

...Expand

: 22204-53-1
(2S)-2-(6-methoxy(2-naphthyl))propanoic acid

A: 302-17-0
chloral hydrate

B: 67-66-3
chloroform

C: 513-88-2
1,1-Dichloroacetone

D: 918-00-3
1,1,1-trichloroacetone

Conditions

Conditions	Yield
With chlorine In aq. phosphate buffer pH=7; Kinetics; pH-value; UV-irradiation;

...Expand

: 104-53-0
3-phenyl-propionaldehyde

: 918-00-3
1,1,1-trichloroacetone

: 3-chloro-6-phenylhex-3(Z)-en-2-one

Conditions

Conditions	Yield
With chromium dichloride; hydrogen; magnesium bromide; Pd/C (10percent) In tetrahydrofuran at 20℃; for 0.5h;	99%

: 918-00-3
1,1,1-trichloroacetone

: 100-52-7
benzaldehyde

: 53973-14-1, 148470-37-5, 119856-19-8
(Z)-2-Chloro-1-phenyl-1-buten-3-one

Conditions

Conditions	Yield
With chromium dichloride; hydrogen; magnesium bromide; Pd/C (10percent) In tetrahydrofuran at 20℃; for 0.5h;	99%

: 918-00-3
1,1,1-trichloroacetone

: 100-63-0
phenylhydrazine

: 114-83-0
1-acetyl-2-phenylhydrazine

Conditions

Conditions	Yield
With triethylamine In acetonitrile for 8h; Heating;	98%

: 918-00-3
1,1,1-trichloroacetone

: 107-15-3
ethylenediamine

: 871-78-3
N,N'-diacetylethylenediamine

Conditions

Conditions	Yield
In hexane at 25℃;	97%

: 918-00-3
1,1,1-trichloroacetone

: 39687-95-1
isocyanoacetic acid methyl ester

: (4R,5R)-5-Methyl-5-trichloromethyl-4,5-dihydro-oxazole-4-carboxylic acid methyl ester

Conditions

Conditions	Yield
With triethylamine; copper(l) chloride In 1,2-dichloro-ethane at 18 - 23℃; for 0.5h;	95%
With triethylamine; copper(l) chloride In 1,2-dichloro-ethane for 0.5h; Ambient temperature;	95%

: 918-00-3
1,1,1-trichloroacetone

: 107-13-1
acrylonitrile

: 2,4,4-Trichloro-5-oxo-hexanenitrile

Conditions

Conditions	Yield
With copper(l) chloride at 110℃; for 12h;	90%

: 918-00-3
1,1,1-trichloroacetone

: 109-73-9
N-butylamine

: 1119-49-9
N-butylacetamide

Conditions

Conditions	Yield
In hexane at 25℃;	88%

: 918-00-3
1,1,1-trichloroacetone

: 100-52-7
benzaldehyde

: 3,3-dichloro-4-hydroxy-4-phenyl-butan-2-one

Conditions

Conditions	Yield
With chromium dichloride; hydrogen; magnesium bromide; Pd/C (10percent) In tetrahydrofuran at 0℃; for 12h;	87%

: 110-91-8
morpholine

: 918-00-3
1,1,1-trichloroacetone

: 1696-20-4
4-acetylmorpholine

Conditions

Conditions	Yield
In hexane at 25℃;	86%

: 107-10-8
propylamine

: 918-00-3
1,1,1-trichloroacetone

: 5331-48-6
n-propylacetamide

Conditions

Conditions	Yield
In hexane at 25℃;	85%

: 918-00-3
1,1,1-trichloroacetone

: 1197-22-4
N-phenylmethanesulfonamide

: 3700-65-0
N-(methylsulfonyl)-N-phenylacetamide

Conditions

Conditions	Yield
With Aliquat 336; sodium carbonate In acetonitrile at 80℃; for 2h;	85%

: 918-00-3
1,1,1-trichloroacetone

: 75-31-0
isopropylamine

: 1118-69-0
N-isopropylacetamide

Conditions

Conditions	Yield
In hexane at 25℃;	85%

: 918-00-3
1,1,1-trichloroacetone

: 100-46-9
benzylamine

: 588-46-5
N-(phenylmethyl)acetamide

Conditions

Conditions	Yield
In hexane at 25℃;	85%
With aniline In chloroform compatitive reaction with aniline; reaction condition: 1) 5 - 10 deg C, 30 min; 2) 25 deg C, 1 h;	80%

: 918-00-3
1,1,1-trichloroacetone

: (R)-1,1,1-trichloropropan-2-ol

Conditions

Conditions	Yield
With Noyori's catalyst In formic acid; triethylamine at 28℃; for 17h; Reagent/catalyst; Inert atmosphere;	85%

: 33966-50-6
SEC-BUTYLAMINE

: 918-00-3
1,1,1-trichloroacetone

: 1189-05-5
N-(2-butyl)ethanamide

Conditions

Conditions	Yield
In hexane at 25℃;	82%

: 104-53-0
3-phenyl-propionaldehyde

: 918-00-3
1,1,1-trichloroacetone

: 3,3-dichloro-4-hydroxy-6-phenyl-hexan-2-one

Conditions

Conditions	Yield
With chromium dichloride; hydrogen; magnesium bromide; Pd/C (10percent) In tetrahydrofuran at 0℃; for 12h;	82%

: 918-00-3
1,1,1-trichloroacetone

: 1082905-88-1
1,1,1-trichloro-2-sulfanylpropan-2-ol

Conditions

Conditions	Yield
With hydrogenchloride; hydrogen sulfide In methanol at -50℃;	81%

: 918-00-3
1,1,1-trichloroacetone

: 1-(2-nitro-4,5-dimethoxyphenyl)-2-aminopropane hydrochloride

: N-[2-(4,5-Dimethoxy-2-nitro-phenyl)-1-methyl-ethyl]-acetamide

Conditions

Conditions	Yield
With triethylamine In acetonitrile at 25℃; for 1h;	80%

: 918-00-3
1,1,1-trichloroacetone

: 79894-70-5
methyl-2,2,2-trichloroacetimidate

Conditions

Conditions	Yield
With pyridine; hydroxylamine In ethanol	80%

: 918-00-3
1,1,1-trichloroacetone

: 62-53-3
aniline

: 103-84-4
Acetanilid

Conditions

Conditions	Yield
With triethylamine In hexane Heating;	80%

: 918-00-3
1,1,1-trichloroacetone

: 6758-40-3
p-Nitrobenzoyl-L-(+)-glutamic acid

: 2387-48-6
2,4-diamino-5-nitroso-6-hydroxypyrimidine

: 59-30-3
folate

Conditions

Conditions	Yield
Stage #1: p-Nitrobenzoyl-L-(+)-glutamic acid; 2,4-diamino6-hydroxy-5-nitroso pyrimidine With hydrogen In water at 82℃; under 6000.6 Torr; Stage #2: 1,1,1-trichloroacetone With sodium metabisulfite; sodium hydroxide In water at 45℃; pH=4.5; pH-value; Pressure; Temperature;	80%

...Expand

: 918-00-3
1,1,1-trichloroacetone

: 4271-30-1
N-(4-aminobenzoyl)-L-glutamic acid

: 35011-47-3
2,4,5-triamino-6-hydroxypyrimidine sulfate

: 59-30-3
folate

Conditions

Conditions	Yield
Stage #1: 1,1,1-trichloroacetone; N-(4-aminobenzoyl)-L-glutamic acid With sodium acetate; sodium sulfite In acetic acid at 43℃; for 0.5h; Stage #2: 2,4,5-triamino-6-hydroxypyrimidine sulfate In acetic acid at 38℃; for 5h;	75.5%

...Expand

: 110-89-4
piperidine

: 918-00-3
1,1,1-trichloroacetone

: 618-42-8
1-piperidin-1-yl-ethanone

Conditions

Conditions	Yield
In hexane at 25℃;	75%

: 918-00-3
1,1,1-trichloroacetone

: 1-(2-nitro-4,5-methylenedioxyphenyl)-2-aminopropane hydrochloride

: N-[1-Methyl-2-(6-nitro-benzo[1,3]dioxol-5-yl)-ethyl]-acetamide

Conditions

Conditions	Yield
With triethylamine In acetonitrile at 25℃; for 1h;	75%

: 918-00-3
1,1,1-trichloroacetone

: 51425-58-2
(Z)-1-(trimethylsiloxy)-1-decene

: 2-(2,2,2-trichloro-1-hydroxy-1-methyl-ethyl)-decanal

Conditions

Conditions	Yield
Stage #1: (Z)-1-(trimethylsiloxy)-1-decene With methyllithium In tetrahydrofuran at 0℃; for 0.5h; Metallation; Stage #2: With tetrabutoxytitanium In tetrahydrofuran at 0℃; for 0.5h; complexation; Stage #3: 1,1,1-trichloroacetone In tetrahydrofuran at 0℃; for 1h; Condensation;	72%

: 918-00-3
1,1,1-trichloroacetone

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 1010796-56-1
(E)-3-dimethylamino-1,1,1-trichloro-3-buten-2-one

Conditions

Conditions	Yield
With boron trifluoride diethyl etherate In toluene at 110℃; for 24h;	68%

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

Product Name

1,1,1-TRICHLOROACETONE

Synthetic route

1,1,1-Trichloropropanone Chemical Properties

1,1,1-Trichloropropanone Uses

1,1,1-Trichloropropanone Toxicity Data With Reference

1,1,1-Trichloropropanone Safety Profile

Related Products

Hot Products