3-Phenoxypropanoic acid

Basic Information

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CAS Number

7170-38-9

Molecular Formula

C9H10O3

Molecular Weight

166.18 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

Basic Physical Properties

Melting Point

98°C

Boiling Point

245°C

Density

1.1708 (rough estimate)

Flash Point

243-245°C

Refractive Index

1.5184 (estimate)

SMILES

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C1=CC=C(C=C1)OCCC(=O)O

InChI

InChI=1S/C9H10O3/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

InChIKey

BUSOTUQRURCMCM-UHFFFAOYSA-N

LogP

1.5400999999999996

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

139

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

HMS1405O07
AI3-20895
DTXSID10221921
3-phenoxypropanoate
beta-phenoxypropionate
.beta.-Phenoxypropionic acid
InChI=1/C9H10O3/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11
SCHEMBL38674
AB00261
3-Phenoxypropionate
STR03461
3-phenoxy-propanoate
J-513028
PS-3696
Propanoic acid, 3-phenoxy-
3-phenoxy-propionic acid
b-phenoxypropionic acid
Enamine_004187
EINECS 230-518-4
CHEBI:169989
CS-W004102
Z56854475
AM83175
3-phenoxy-propanoic acid
3-Phenoxypropanoic acid
SY048787
3-(phenyloxy)propanoic acid
3-Penoxypropionic acid
7170-38-9
3-Phenoxypropionic acid, 99%
EN300-16992

MDL Number

MFCD00002769

Customs Code

2918990090

FAQ

What is 3-Phenoxypropanoic acid (CAS: 7170-38-9)?

3-Phenoxypropanoic acid, with CAS number 7170-38-9, is a white or slightly yellow crystalline solid. It is an organic compound with the molecular formula C9H10O3. This acid is known for its aromatic and carboxylic acid functionalities, which contribute to its chemical reactivity and solubility properties.

What are the main uses of 3-Phenoxypropanoic acid (CAS: 7170-38-9)?

3-Phenoxypropanoic acid is primarily used in the pharmaceutical industry as a precursor for the synthesis of other compounds. It is also utilized in the production of flavors and fragrances, where its aromatic properties make it valuable. Additionally, it can be used in agricultural chemicals and as a research reagent.

Is 3-Phenoxypropanoic acid (CAS: 7170-38-9) safe?

3-Phenoxypropanoic acid is generally considered safe under proper handling conditions. However, as with any chemical, it is important to follow safety guidelines. It is toxic if swallowed and can cause skin irritation. Proper protective equipment, such as gloves and safety glasses, should be worn during handling. Avoid contact with eyes and skin, and ensure good ventilation.

How should 3-Phenoxypropanoic acid (CAS: 7170-38-9) be stored?

3-Phenoxypropanoic acid should be stored in a cool, dry place away from direct sunlight and heat sources to prevent degradation. Store it in a tightly sealed container to protect against moisture and contamination. Ideal storage conditions include a temperature range of 15-25°C (59-77°F) and a relative humidity below 50%. Ensure the container is labelled appropriately to avoid confusion with other substances.