3-(3-Chlorophenoxy)propanoic acid

Basic Information

View in Editor

CAS Number

7170-50-5

Molecular Formula

C9H9ClO3

Molecular Weight

200.62 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Flash Point

140.2℃

SMILES

View in Editor

C1=CC(=CC(=C1)Cl)OCCC(=O)O

InChI

InChI=1S/C9H9ClO3/c10-7-2-1-3-8(6-7)13-5-4-9(11)12/h1-3,6H,4-5H2,(H,11,12)

InChIKey

QSGKVNYPPAQLDO-UHFFFAOYSA-N

LogP

2.1935000000000002

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

172

Synonyms & References

English

7170-50-5
3-(3-CHLORO-PHENOXY)-PROPIONIC ACID
MFCD00151673
NS00037278
PROPANOIC ACID, 3-(3-CHLOROPHENOXY)-
EINECS 230-522-6
3-(3-chlorophenoxy)propanoic acid
3-(3-Chlorophenoxy)propionicAcid
EN300-37419
AN-584/13156516
DTXSID90221924
Propionic acid, 3-(m-chlorophenoxy)-
AC1669
AKOS000130665
SCHEMBL3728368
FT-0691892
FS-5603
R2C6P3JK39
A837298
CS-0005243
SY008354
AB03979
Z240085186
3-(3-Chlorophenoxy)propionic acid
3-(3-Chlorophenoxy)propanoic acid
3-(3-Chloro-phenoxy)-propionic acid
FMOC-LYS(ME3)-OH
PubChem19224
SBB092669
1138AC
ST2417356

MDL Number

MFCD00151673

Customs Code

2918990090

FAQ

What are the physical and chemical properties of 3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5)?

3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5) is a crystalline solid with a molecular weight of 233.63 g/mol. It has a pKa of approximately 5.2 and is slightly soluble in water. The compound is reactive towards hydroxylamine and can undergo esterification reactions. It is also known for its ability to form salts and esters.

How is 3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5) typically synthesized?

3-(3-Chlorophenoxy)propanoic acid is typically synthesized by reacting 3-chlorophenol with propanoyl chloride in the presence of a base such as sodium hydroxide. The reaction is conducted at room temperature and provides a yield of about 75-80%. The product is then purified by recrystallization from ethanol.

What industries use 3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5)?

3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5) is primarily used in the pharmaceutical industry for the synthesis of various bioactive compounds. It is also utilized in the production of certain pesticides and herbicides due to its chlorophenoxy functionality. Additionally, it has applications in the polymer industry for enhancing the properties of certain polymers.

What precautions should be taken when handling 3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5)?

When handling 3-(3-Chlorophenoxy)propanoic acid (CAS: 7170-50-5), ensure the use of chemical-resistant gloves, safety goggles, and a laboratory coat. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation of fumes. Spills should be cleaned up with absorbent paper and disposed of according to local regulations. It is important to always refer to the Material Safety Data Sheet (MSDS) for detailed information on safety and handling procedures.