Basic information
- Name:
Butanoic acid, 4-chloro-4-oxo-, ethyl ester
- Superlist Name:
- Ethyl succinyl chloride
- CAS No.:
14794-31-1
- Molecular Structure:

- Formula:
- C6H9ClO3
- Molecular Weight:
- 164.59
- Deleted CAS:
- 97900-84-0|473694-30-3
- Synonyms:
- Propionicacid, 3-(chloroformyl)-, ethyl ester (6CI,7CI,8CI);3-(Ethoxycarbonyl)propanoylchloride;3-Chlorocarbonylpropionic acid ethyl ester;4-Ethoxy-4-oxobutanoic acid chloride;Ethyl 3-chlorocarbonylpropionate;Ethyl 4-chloro-4-oxobutyrate;b-Ethoxycarbonylpropionyl chloride;
- EINECS:
- 238-855-9
- Density:
- 1.179 g/cm3
- Boiling Point:
- 207.8 °C at 760 mmHg
- Flash Point:
- 84.4 °C
- Appearance:
- clear colourless to yellow liquid
- Hazard Symbols:
C- Risk Codes:
- 34-36/37-14
- Safety Description:
- 26-27-36/37/39-45-24/25 Details
- Transport Information:
- UN 3265 8/PG 2
- particular:
- particular
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Chemistry
Molecular Structure of Butanoic acid, 4-chloro-4-oxo-, ethyl ester (CAS NO.14794-31-1):
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IUPAC Name: ethyl 4-chloro-4-oxobutanoate
Empirical Formula: C6H9ClO3
Molecular Weight: 164.5869
Sensitive: Moisture Sensitive
BRN: 1766126
EINECS: 238-855-9
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 43.37Å2
Index of Refraction: 1.436
Molar Refractivity: 36.49 cm3
Molar Volume: 139.5 cm3
Surface Tension: 34.8 dyne/cm
Density: 1.179 g/cm3
Flash Point: 84.4 °C
Enthalpy of Vaporization: 44.41 kJ/mol
Boiling Point: 207.8 °C at 760 mmHg
Vapour Pressure: 0.22 mmHg at 25°C
InChI
InChI=1/C6H9ClO3/c1-2-10-6(9)4-3-5(7)8/h2-4H2,1H3
Smiles
O=C(OCC)CCC(Cl)=O
Safety Profile
Hazard Codes:
C
Risk Statements: 34-36/37-14
R34:Causes burns.
R36/37:Irritating to eyes and respiratory system.
R14 :Reacts violently with water.
Safety Statements: 26-27-36/37/39-45-24/25
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S27:Take off immediately all contaminated clothing.
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.)
S24/25:Avoid contact with skin and eyes.
RIDADR: UN 3265 8/PG 2
WGK Germany: 3
HazardClass: 8
PackingGroup: II
Specification
Butanoic acid, 4-chloro-4-oxo-, ethyl ester , with CAS number of 14794-31-1, can be called Ethyl 3-(chloroformyl)propionate ; 3-Carbethoxypropionyl chloride ; 3-Chlorocarbonylpropionic acid ethyl ester ; 4-Chloro-4-oxobutanoic acid ethylester ; 4-Ethoxy-4-oxobutanoic acid chloride ; Monoethylsuccinoyl chloride ; b-Ethoxycarbonylpropionyl chloride ; b-Carbethoxypropionyl chloride . It is a clear colourless to yellow liquid.

