4-Chloro-1,1-diethoxybutane

Basic Information

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CAS Number

6139-83-9

Molecular Formula

C8H17ClO2

Molecular Weight

180.67 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

92°C/20mmHg

Density

0.976

Flash Point

51.1 ºC

Refractive Index

1.4337

SMILES

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CCOC(CCCCl)OCC

InChI

InChI=1S/C8H17ClO2/c1-3-10-8(11-4-2)6-5-7-9/h8H,3-7H2,1-2H3

InChIKey

JGGRHRMHOUWCDX-UHFFFAOYSA-N

LogP

2.4045000000000005

Topological Polar Surface Area

18.46 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

72.5

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

4-Chloro-1,1-diethoxybutane (4-Chlorobutyraldehyde Diethyl Acetal)
NCIOpen2_001659
4-Chloro-1,1-diethoxybutane; 4-Chlorobutanal diethyl acetal; 4-Chlorobutyraldehyde diethyl acetal; NSC 96467
AC-1447
JGGRHRMHOUWCDX-UHFFFAOYSA-N
4-chloro-butyraldehyde diethyl acetal
4,4-diethoxybutyl chloride
BP-31231
NSC96467
NS00122505
DTXSID30294410
AMY10393
4-Chlorbutyraldehyde diethylacetal
AKOS006230074
NSC 96467
4-Chlorobutyraldehyde diethyl acetal
Q-200449
Butane, 4-chloro-1,1-diethoxy-
C2717
Butyraldehyde, 4-chloro-, diethyl acetal
SCHEMBL432588
SY030500
NSC-96467
AC1911
22AV7T3NYX
FT-0601150
CS-0014683
6139-83-9
1-chloro-4,4-diethoxy-butane
MFCD00671476
4-Chloro-1,1-dethoxybutane

MDL Number

MFCD00671476

Customs Code

2942000000

FAQ

What are the physical and chemical properties of 4-Chloro-1,1-diethoxybutane (CAS: 6139-83-9)?

4-Chloro-1,1-diethoxybutane is a colorless, slightly viscous liquid with a molecular weight of approximately 187.2 g/mol. It has a low solubility in water but is soluble in organic solvents. Chemically, it is relatively stable but can react with strong bases to form 1,1-diethoxybutane and hydrochloride. It is poorly soluble in water and has a melting point of -28°C and a boiling point of 126°C.

How is 4-Chloro-1,1-diethoxybutane (CAS: 6139-83-9) typically synthesized?

4-Chloro-1,1-diethoxybutane can be synthesized via the reaction of 1,1-diethoxybutane with hydrogen chloride. The reaction is typically performed at room temperature in the presence of a suitable catalyst. The yield is around 85%, and the product is isolated by distillation.

What industries use 4-Chloro-1,1-diethoxybutane (CAS: 6139-83-9)?

4-Chloro-1,1-diethoxybutane is used in the pharmaceutical industry as a starting material for the synthesis of other compounds. It is also utilized in the production of polymers and as a reagent in the semiconductor industry for the fabrication of electronic devices. Additionally, it serves as a precursor in the development of chemical sensors.

What precautions should be taken when handling 4-Chloro-1,1-diethoxybutane (CAS: 6139-83-9)?

When handling 4-Chloro-1,1-diethoxybutane, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed instructions and emergency procedures.