Ethyl 4-chloro-3-hydroxybutanoate

Basic Information

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CAS Number

10488-69-4

Molecular Formula

C6H11ClO3

Molecular Weight

166.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

136 ºC

Boiling Point

155-157 ºC (10 Torr)

Flash Point

113.1±21.8 ºC,

Refractive Index

1.452 (589.3 nm 22.5 ºC)

SMILES

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CCOC(=O)CC(CCl)O

InChI

InChI=1S/C6H11ClO3/c1-2-10-6(9)3-5(8)4-7/h5,8H,2-4H2,1H3

InChIKey

ZAJNMXDBJKCCAT-UHFFFAOYSA-N

LogP

0.5393000000000001

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

105

Synonyms & References

English

W-200732
Butanoic acid, 4-chloro-3-hydroxy-, ethyl ester
AB88673
MFCD09839767
SY030037
ethyl 4-chloro-3-hydroxybutanoate
Ethyl-4-Chloro-4-HydroxyButyrate;Ethyl 4-Chloro-3-hydroxybutanoate
Ethyl 4-chloro-3-hydroxybutyrate
AKOS006223727
Benzene, 1-ethynyl-4-propoxy-
SY018986
FT-0697234
AS-81031
4-chloro-3-hydroxybutanoic acid ethyl ester
ethyl(S)-4-chloro-3-hydroxybutyrate
ZAJNMXDBJKCCAT-UHFFFAOYSA-N
ethyl4-chloro-3-hydroxybutanoate
A19568
10488-69-4
(+)-ethyl 4-chloro-3-hydroxybutanoate
ethyl (r)-4-chloro-3-hydroxybutanoate
SCHEMBL214007
ethyl-4-chloro-3-hydroxybutyrate
FT-0697233
AMY22171
AB89330
EN300-82539
FT-0625809
FT-0605328
DTXSID90402594
4-chloro-3-hydroxybutyric acid ethyl ester

MDL Number

MFCD09839767

FAQ

What are the physical and chemical properties of Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4)?

Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4) is a crystalline solid with a molecular weight of approximately 210.58 g/mol. It has a melting point of 77-79°C and is slightly soluble in water. The compound is reactive towards nucleophiles and can undergo substitution reactions. It is used in organic synthesis due to its functional groups.

How is Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4) typically synthesized?

Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4) can be synthesized via a multi-step process starting from succinic anhydride and chloroacetic acid. The reaction involves the formation of an intermediate ester followed by hydroxylation and chlorination steps. Catalysts such as pyridine or triethylamine are typically used to improve selectivity and yield.

What industries use Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4)?

Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4) is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in the polymer industry for the production of special plastics and in the chemical industry for various organic synthesis reactions.

What precautions should be taken when handling Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4)?

When handling Ethyl 4-chloro-3-hydroxybutanoate (CAS: 10488-69-4), appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat should be worn. This compound should be stored in a cool, dry environment away from direct sunlight and heat sources. In case of spills, handle in a fume hood and consult the Safety Data Sheet (SDS) for specific cleanup procedures.