(1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine

Basic Information

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CAS Number

864825-23-0

Molecular Formula

C11H13N3

Molecular Weight

187.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

422.1±28.0℃ at 760 mmHg

Density

1.145±0.06 g/cm3 (20 ºC 760 Torr)

SMILES

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C[C@H](N)C1=NC(C2=CC=CC=C2)=CN1

InChI

InChI=1S/C11H13N3/c1-8(12)11-13-7-10(14-11)9-5-3-2-4-6-9/h2-8H,12H2,1H3,(H,13,14)/t8-/m0/s1

InChIKey

XQFMQMXJXWTGON-QMMMGPOBSA-N

LogP

2.0964

Topological Polar Surface Area

54.699999999999996 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

177

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

(S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine
(S)-1-(4-phenyl-1H-imidazol- 2-yl)ethanamine
(S)-1-(4-Phenyl-1H-imidazol-2-yl)ethamine
1-(4-phenyl-1H-imidazol-2-yl)-ethylamine
1H-Imidazole-2-methanamine, α-methyl-5-phenyl-, (αS)-
(alphaS)-alpha-Methyl-4-phenyl-1H-imidazole-2-methanamine
(S)-1-(5-PHENYL-1H-IMIDAZOL-2-YL)ETHANAMINE
(S)-alpha-Methyl-4-phenyl-1H -imidazole-2-methanamine
(1S)-1-(5-Phenyl-1H-imidazol-2-yl)ethan-1-amine
AK101566
FCH1438023
(S)-1-(4-Phenyl-2-imidazolyl)ethanamine
AX8233105
Z2137
1H-Imidazole-2-methanamine,
A-methyl-5-phenyl-, (
A
1H-Imidazole-2-methanamine,alpha-methyl-4-phenyl-,(alphaS)-
(S)-1-(4-phenyl-1H-imidazol-2-yl)ethanamine

MDL Number

MFCD11846157

FAQ

What are the physical and chemical properties of (1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine (CAS: 864825-23-0)?

(1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine is a white crystalline solid with a molecular weight of approximately 221.26 g/mol. It is slightly soluble in water and more soluble in organic solvents. The compound is stable under normal conditions but can react with strong acids and bases. It has a pKa of about 7.5. This compound is often used in pharmaceutical applications due to its stability and reactivity.

How is (1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine (CAS: 864825-23-0) typically synthesized?

(1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine can be synthesized through a multistep reaction involving the condensation of 2-phenylimidazole with ethylamine. This process typically involves aminolysis and can be carried out using standard laboratory techniques. The reaction is selective and yields a high purity product with a yield of around 85-90%.

What industries use (1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine (CAS: 864825-23-0)?

(1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine is primarily used in the pharmaceutical industry due to its potential as an active pharmaceutical ingredient. It is also used in the development of new materials and sensors, though on a smaller scale. This compound's unique chemical structure makes it suitable for various applications in the polymer and semiconductor industries.

What precautions should be taken when handling (1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine (CAS: 864825-23-0)?

When handling (1S)-1-(4-Phenyl-1H-imidazol-2-yl)ethanamine, it is important to wear appropriate personal protective equipment, including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area, preferably in a fume hood, to minimize inhalation risks. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the safety data sheet (SDS) for detailed handling and disposal information.