2-(3,5-Dichlorophenyl)ethanol

Basic Information

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CAS Number

93427-13-5

Molecular Formula

C8H8Cl2O

Molecular Weight

191.06 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

277 ºC

Density

1.329

Flash Point

117 ºC

SMILES

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C1=C(C=C(C=C1Cl)Cl)CCO

InChI

InChI=1S/C8H8Cl2O/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2

InChIKey

HTPYSVJHLUKSRE-UHFFFAOYSA-N

LogP

2.528200000000001

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

109

Synonyms & References

English

2-(3,5-Dichlorophenyl)ethanol
3,5-dichlorophenethyl alcohol
CK1128
3,5-Dichlorobenzeneethanol (ACI)
2-(3,5-Dichlorophenyl)ethan-1-ol
3,5-Dichlorophenethyl alcohol
2-(3,5-dichlorophenyl)ethan-1-ol
Z1201623278
CS-0059812
MFCD06201039
AKOS006344279
SCHEMBL2249765
SY162703
3,5-dichlorophenethyl alcohol, AldrichCPR
AS-45832
93427-13-5
2-(3,5-dichlorophenyl)ethanol
DTXSID10374188
EN300-180922

MDL Number

MFCD06201039

FAQ

What are the physical and chemical properties of 2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5)?

2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5) is a white crystalline solid with a molecular weight of 212.03 g/mol. It is sparingly soluble in water but readily soluble in organic solvents like ethanol and acetone. Chemically, it is relatively stable but can react with strong bases to form corresponding salts. It has a pKa of approximately 16.5.

How is 2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5) typically synthesized?

2-(3,5-Dichlorophenyl)ethanol can be synthesized via the reduction of 2-(3,5-dichlorophenyl)acetaldehyde using sodium borohydride as a reducing agent. This process offers high selectivity and yields up to 95% of the desired product. The reaction is typically performed under mild conditions in ethanol or methanol.

What industries use 2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5)?

2-(3,5-Dichlorophenyl)ethanol finds applications in the pharmaceutical industry for the synthesis of certain drugs. It is also used in the production of dyes, pesticides, and as an intermediate in the manufacturing of organic materials. Its use in sensors and polymers is less common but has potential in niche applications.

What precautions should be taken when handling 2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5)?

When handling 2-(3,5-Dichlorophenyl)ethanol (CAS: 93427-13-5), it is important to use proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a cool, dry place away from direct sunlight. In case of accidental spill, neutralize with an appropriate base and dispose of according to local regulations. Always refer to the Safety Data Sheet (SDS) for specific handling instructions.