3-Chloro-2,2-dimethylpropanoic acid

Basic Information

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CAS Number

13511-38-1

Molecular Formula

C5H9ClO2

Molecular Weight

136.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Melting Point

42.0 to 45.0 deg-C

Boiling Point

131°C/30mmHg

Refractive Index

1.4445 (estimate)

SMILES

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CC(C)(CCl)C(=O)O

InChI

InChI=1S/C5H9ClO2/c1-5(2,3-6)4(7)8/h3H2,1-2H3,(H,7,8)

InChIKey

YBJGQSNSAWZZHL-UHFFFAOYSA-N

LogP

1.336

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

98.6

Safety Information

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Hazard Statement

H290 May be corrosive to metals
Corrosive to Metals

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

NSC89696
UNII-H601192X41
13511-38-1
3-Chloro-2,2-dimethylpropanoic acid
EN300-20324
CS-0140560
.beta.-Chloropivalic acid
NSC 89696
beta-Chloro-alpha,alpha-dimethylpropionic acid
MFCD00004195
AKOS009031436
Q27279684
3-Chloro-2,2-dimethylpropanoic acid #
D84180
EINECS 236-848-5
AS-62191
beta-Chloropivalic acid
Propanoic acid,3-chloro-2,2-dimethyl-
CHLORO-2,2-DIMETHYLPROPANOIC ACID, 3-
InChI=1/C5H9ClO2/c1-5(2,3-6)4(7)8/h3H2,1-2H3,(H,7,8
FT-0636906
J-006648
Propionic acid, 3-chloro-2,2-dimethyl-
3-Chloropivalic acid
NSC-89696
3-Chloro-2,2-dimethylpropaneoic acid
3-Chloro-2,2-dimethylpropionic acid, 99%
.beta.-Chloro-.alpha.,.alpha.-dimethylpropionic acid
SCHEMBL159468
SY051586
Chlorotrimethylacetic acid

MDL Number

MFCD00004195

Customs Code

2915900090

FAQ

What is 3-Chloro-2,2-dimethylpropanoic acid (CAS: 13511-38-1)?

3-Chloro-2,2-dimethylpropanoic acid is an organic compound with the CAS number 13511-38-1. It is a colorless liquid with a chloroform-like odor and is used in various applications such as pharmaceuticals, industrial chemicals, and research. The chemical formula is C6H9ClO2 and it has a boiling point of 82.5°C and a density of 1.218 g/cm³.

What are the main uses of 3-Chloro-2,2-dimethylpropanoic acid (CAS: 13511-38-1)?

3-Chloro-2,2-dimethylpropanoic acid is primarily used as a precursor in the synthesis of various organic compounds, including pharmaceuticals and agrochemicals. It is also utilized in the production of resins and plasticizers. Its applications span pharmaceuticals, industry, and research.

Is 3-Chloro-2,2-dimethylpropanoic acid (CAS: 13511-38-1) safe?

3-Chloro-2,2-dimethylpropanoic acid is generally considered safe when handled with appropriate precautions. However, it is a flammable liquid and may irritate the skin and eyes. Proper protective measures such as gloves and safety glasses should be worn during handling. It is also important to avoid inhalation and contact with skin or eyes.

How should 3-Chloro-2,2-dimethylpropanoic acid (CAS: 13511-38-1) be stored?

3-Chloro-2,2-dimethylpropanoic acid should be stored in a cool, well-ventilated area away from heat and sources of ignition. It should be kept in a tightly sealed container and protected from moisture and light. The storage temperature should not exceed 25°C. Ensure the container is well-labeled and stored in a secure location to prevent accidental exposure or contamination.