3-(Isopropylamino)-1,2-propanediol

Basic Information

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CAS Number

6452-57-9

Molecular Formula

C6H15NO2

Molecular Weight

133.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

254.4±25.0 ºC (760 Torr),

Density

1.007±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

118.4±13.7 ºC,

SMILES

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CC(C)NCC(O)CO

InChI

InChI=1S/C6H15NO2/c1-5(2)7-3-6(9)4-8/h5-9H,3-4H2,1-2H3

InChIKey

YKBZGEJJKPNRSI-UHFFFAOYSA-N

LogP

-0.6624000000000003

Topological Polar Surface Area

52.489999999999995 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

66.1

Synonyms & References

English

1,2-Propanediol,3-[(1-methylethyl)amino]-
3-(ISOPROPYLAMINO)-1,2-PROPANEDIOL
3-(propan-2-ylamino)propane-1,2-diol
3-Isopropylamino-1,2-propanediol
NELFINAVIR HYDROXY-TERT-BUTYLAMIDE
EINECS 229-255-8
1,2-Dihydroxy-3-isopropylaminopropane
3-(Isopropylamino)propane-1,2-diol
(R)-3-(Isopropylamino)propane-1,2-diol
(S)-3-(Isopropylamino)propane-1,2-diol
3-[(propan-2-yl)amino]propane-1,2-diol
1,2-Propanediol, 3-[(1-methylethyl)amino]-
YKBZGEJJKPNRSI-UHFFFAO
3-(isopropylamino)propane-1,2-diol

MDL Number

MFCD00128146

Customs Code

2922199090

FAQ

What are the physical and chemical properties of 3-(Isopropylamino)-1,2-propanediol (CAS: 6452-57-9)?

3-(Isopropylamino)-1,2-propanediol is a colorless, clear, and crystalline liquid with a molecular weight of approximately 136.23 g/mol. It has a high solubility in water and moderate solubility in organic solvents. The compound is characterized by a slight amine odor. It is a reducing agent and can react with certain oxidizing agents.

How is 3-(Isopropylamino)-1,2-propanediol (CAS: 6452-57-9) typically synthesized?

3-(Isopropylamino)-1,2-propanediol is commonly synthesized via the reaction of isopropylamine with 1,2-propanediol in the presence of a suitable catalyst, such as a strong acid like sulfuric acid. The process involves the nucleophilic substitution of the hydroxy group by the amino group, leading to the formation of the target compound with good yield and selectivity.

What industries use 3-(Isopropylamino)-1,2-propanediol (CAS: 6452-57-9)?

3-(Isopropylamino)-1,2-propanediol finds applications in the pharmaceutical industry as an intermediate for the synthesis of various drugs. It is also used in the polymer industry for the production of polyamides and polyurethanes. Additionally, it is utilized in the manufacturing of sensors and semiconductors for its unique chemical properties.

What precautions should be taken when handling 3-(Isopropylamino)-1,2-propanediol (CAS: 6452-57-9)?

When handling 3-(Isopropylamino)-1,2-propanediol, it is important to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Work should be conducted in a fume hood to minimize exposure to vapors. Spills should be cleaned up using appropriate materials, and the area should be well-ventilated. Always consult the safety data sheet (SDS) for detailed handling and disposal instructions.