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Basic Information
CAS No.: 37517-81-0
Name: Methyl malonyl chloride
Article Data: 14
Molecular Structure:
Molecular Structure of 37517-81-0 (Methyl malonyl chloride)
Formula: C4H5ClO3
Molecular Weight: 136.535
Synonyms: (Carbomethoxy)acetylchloride;(Methoxycarbonyl)acetyl chloride;2-Methoxycarbonylacetyl chloride;3-Chloro-3-oxopropanoic acid methyl ester;Malonic acid chloride monomethylester;Malonic acid monomethyl ester chloride;Methyl (chlorocarbonyl)acetate;Methyl (chloroformyl)acetate;Methyl 2-(chlorocarbonyl)acetate;Methyl2-(chloroformyl)acetate;Methyl 3-chloro-3-oxopropanoate;Methyl3-chloro-3-oxopropionate;
EINECS: 253-540-6
Density: 1.281 g/cm3
Boiling Point: 167.5 °C at 760 mmHg
Flash Point: 80 °C
Solubility: Reacts with water.
Appearance: Clear light yellow to yellow liquid
Hazard Symbols:
Risk Codes: 34-36/37
Safety: 26-36/37/39-45
Transport Information: UN 3265 8/PG 2
PSA: 43.37000
LogP: 0.31490
Synthetic route
16695-14-0

Malonic acid monomethyl ester

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

Conditions
ConditionsYield
With thionyl chloride; N,N-dimethyl-formamide In chloroform Heating;65%
With phosphorus pentachloride In dichloromethane for 0.5h; Heating;
With thionyl chloride In dichloromethane
Stage #1: Malonic acid monomethyl ester In dichloromethane; N,N-dimethyl-formamide at 20℃; for 0.0833333h; Inert atmosphere;
Stage #2: With oxalyl dichloride In dichloromethane; N,N-dimethyl-formamide at 20℃; for 2h; Cooling with ice;
With thionyl chloride at 80℃; for 2h; Inert atmosphere;
38330-80-2

monomethyl monopotassium malonate

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

Conditions
ConditionsYield
With oxalyl dichloride In benzene
With thionyl chloride
With thionyl chloride In dichloromethane for 2h; Ambient temperature;
With hexachloroethane; triphenylphosphine In dichloromethane
With oxalyl dichloride; N,N-dimethyl-formamide In dichloromethane at 0 - 20℃; for 2h; Inert atmosphere;
potassium salt of malonic acid monomethyl ester

potassium salt of malonic acid monomethyl ester

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

Conditions
ConditionsYield
With thionyl chloride; diethyl ether unter Kuehlung mit Eis-Kochsalz-Gemisch;

methyl 3-({4-[(dimethylamino)carbonyl]phenyl}amino)-5-[(4-fluorophenyl)methyl]-2-pyridinecarboxylate

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

3878-55-5

methyl hydrogen succinate

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

Conditions
ConditionsYield
With thionyl chloride In benzene for 1.5h; Reflux;
37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

62-53-3

aniline

76311-94-9

Methyl 2-(N-phenylaminocarbonyl)acetate

Conditions
ConditionsYield
In dichloromethane at 0℃; for 1h;100%
With triethylamine In dichloromethane for 2h; Inert atmosphere;99%
With triethylamine In dichloromethane at 0 - 20℃; for 5h; Inert atmosphere;99%
37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

103-69-5

N-ethyl-N-phenylamine

142613-14-7

methyl 3-(N-ethyl-N-phenylamino)-3-oxopropionate

Conditions
ConditionsYield
In dichloromethane at 20℃; for 14h; Inert atmosphere;100%
With triethylamine In acetone at 2 - 20℃; for 2h; Inert atmosphere;94%
With pyridine
With triethylamine In tetrahydrofuran at 0 - 20℃; for 2h;
37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

136281-04-4

2'-chloro-3,5-dimethyl-2-methylaminobenzophenone

136281-05-5

methyl N-<2-(2-chlorobenzoyl)-4,6-dimethylphenyl>-N-methylmalonylamide

Conditions
ConditionsYield
With triethylamine In ethyl acetate for 1.5h;100%
37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

75-08-1

ethanethiol

methyl 3-ethylthio-3-oxopropanoate

Conditions
ConditionsYield
In dichloromethane at 0 - 20℃;100%
In dichloromethane at 0 - 20℃; for 15h; Inert atmosphere;100%
635-22-3

4-Chloro-3-nitroaniline

37517-81-0

3-chloro-3-oxopropanoic acid methyl ester

852312-59-5

N-(4-chloro-3-nitro-phenyl)-malonamic acid methyl ester

Conditions
ConditionsYield
With triethylamine In dichloromethane at 0 - 20℃;100%
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    Product Name: Methyl malonyl chloride CAS: 37517-81-0 MF: C4H5ClO3 MW: 136.53 EINECS: 253-540-6 Mol File: 37517-81-0.mol Methyl malonyl chloride Structure Methyl malonyl chloride Chemical Properties Boiling point 57-59 °C/

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    37517-81-0

    Methyl 3-chloro-3-oxopropionate

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    API name: Methyl 3-chloro-3-oxopropionate CAS No.: 37517-81-0 Chemical name: Methyl 3-chloro-3-oxopropionate; METHYL3-CHLORO-3-OXOPROPIONATE;METHYLMALONYLCHLORIDE;METHYLCHLOROFORMYLACETATE;AURORAKA-3053;METHYL3-CHLORO-3-OXOPROPIONATE,97%;

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    37517-81-0

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    37517-81-0

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Specification

1.Introduction of Methyl malonyl chloride

Methyl malonyl chloride, with the register CAS NO 37517-81-0, is a kind of Light yellow to yellow clear liquid.It has synonyms of (Carbomethoxy)acetylchloride;(Methoxycarbonyl)acetyl chloride;2-Methoxycarbonylacetyl chloride and 3-Chloro-3-oxopropanoic acid methyl ester. Methyl malonyl chloride should sealed storage in shady and cool warehouse and keep away from sources of ignition.

2.Properties of Methyl malonyl chloride

EINECS: 253-540-6 (2)H bond acceptors: 3 (3)H bond donors: 0(4)Freely Rotating Bonds: 3 (5)Polar Surface Area: 43.37 Å2 (6)Index of Refraction: 1.424(7)Molar Refractivity: 27.23 cm3 (8)Molar Volume: 106.5 cm3 (9)Surface Tension: 35.2 dyne/cm(10)Density: 1.281 g/cm3 (11)Flash Point: 80 °C (12)Enthalpy of Vaporization: 40.4 kJ/mol(13)Boiling Point: 167.5 °C at 760 mmHg (14)Vapour Pressure: 1.69 mmHg at 25°C (15)Storage temp: 2-8°C

3.Structure descriptors of Methyl malonyl chloride

SMILES: O=C(OC)CC(Cl)=OInChI: InChI=1/C4H5ClO3/c1-8-4(7)2-3(5)6/h2H2,1H3InChIKey: UTBCRHAMJFMIIR-UHFFFAOYAEStd. InChI: InChI=1S/C4H5ClO3/c1-8-4(7)2-3(5)6/h2H2,1H3CopyStd. InChIKey: UTBCRHAMJFMIIR-UHFFFAOYSA-N

4.Safety profile of Methyl malonyl chloride

Hazard Codes: C
Risk Statements: 34-36/37
R34: Causes burns.
R36/37:I rritating to eyes and respiratory system.
Safety Statements: 26-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR UN: 3265 8/PG 2
WGK Germany: 3
F: 8-10-19
Hazard Note: Corrosive/Lachrymatory/Keep Cold
HazardClass: 8
PackingGroup: II