(12,12,12-~2~H_3_)Dodecanoic acid

Basic Information

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CAS Number

79050-22-9

Molecular Formula

C12H21D3O2

Molecular Weight

203.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

44-46 °C

Boiling Point

225 °C100 mm Hg

Flash Point

>230 °F(lit.)

SMILES

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CCCCCCCCCCCC(=O)O

InChI

InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14)/i1D3

InChIKey

POULHZVOKOAJMA-FIBGUPNXSA-N

LogP

3.991900000000002

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

132

Synonyms & References

English

D98499
AKOS015892832
Lauric acid-d3
LMFA01010043
79050-22-9
DODECANOIC-12,12,12-D3 ACID
12,12,12-trideuteriododecanoic acid
Lauric acid(d3)
Dodecanoic acid(d3)
HY-Y0366S3
Lauric acid-12,12,12-d3, 98 atom % D
CS-0368830
DTXSID30583851
SCHEMBL16794735
(12,12,12-~2~H_3_)Dodecanoic acid
Dodecanoic-12,12,12-d3acid (9CI)
12,12,12-trideuterio-dodecanoic acid
12,12,12-Trideuterio-dodecansaeure
485608_ALDRICH
Dodecanoic acid-12,12,12-d3
dodecanoic-12,12,12-d3 acid
I04-10064
Lauric acid-12,12,12-d3

MDL Number

MFCD00190437

FAQ

What are the physical and chemical properties of (12,12,12-~2~H_3_)Dodecanoic acid (CAS: 79050-22-9)?

(12,12,12-~2~H_3_)Dodecanoic acid is a white to off-white crystalline solid with a high melting point and low solubility in water. It has a molecular weight of approximately 301.4 g/mol and exhibits mild reactivity under normal conditions. The acid shows limited solubility in common organic solvents such as ethanol and acetone, and it is prone to hydrolysis under basic conditions.

How is (12,12,12-~2~H_3_)Dodecanoic acid (CAS: 79050-22-9) typically synthesized?

(12,12,12-~2~H_3_)Dodecanoic acid can be synthesized through the hydrolysis of dodecanoyl chloride followed by the deuterium exchange reaction. The process involves the reaction of dodecanoic acid with deuterium gas over a catalyst like rhodium acetate at elevated temperatures. The yield and selectivity of the reaction can be controlled by adjusting the reaction conditions.

What industries use (12,12,12-~2~H_3_)Dodecanoic acid (CAS: 79050-22-9)?

(12,12,12-~2~H_3_)Dodecanoic acid is primarily used in the pharmaceutical industry for the synthesis of deuterated drugs and in the polymer industry for the production of deuterated polymers. It also finds applications in the development of sensors and semiconductors due to its stable deuterium content.

What precautions should be taken when handling (12,12,12-~2~H_3_)Dodecanoic acid (CAS: 79050-22-9)?

When handling (12,12,12-~2~H_3_)Dodecanoic acid, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up using appropriate absorbent materials, and the area should be flushed with water. Safety data sheets (SDS) should be consulted for comprehensive safety information and emergency procedures.