1-[(Aminooxy)methyl]-4-methoxybenzene

Basic Information

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CAS Number

21038-22-2

Molecular Formula

C8H11NO2

Molecular Weight

153.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

SMILES

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COc1ccc(CON)cc1

InChI

InChI=1S/C8H11NO2/c1-10-8-4-2-7(3-5-8)6-11-9/h2-5H,6,9H2,1H3

InChIKey

MVSMBIBGGPSEHQ-UHFFFAOYSA-N

LogP

1.0855

Topological Polar Surface Area

44.480000000000004 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

100

Synonyms & References

English

O-(4-Methoxybenzyl)hydroxylamine
O-[(4-methoxyphenyl)methyl]Hydroxylamine
p-methoxybenzyloxyamine
Hydroxylamine, O-(p-methoxybenzyl)-
Hydroxylamine, O-[(4-methoxyphenyl)methyl]-
o-(p-methoxybenzyl)hydroxylamine
O-(p-methoxybenzyl)-hydroxylamine
MVSMBIBGGPSEHQ-UHFFFAOYSA-N
O-(4-methoxy-benzyl)-hydroxylamine
1[(aminooxy)methyl]-4-met
O-(4-methoxyphenyl)methylhydroxylamine

MDL Number

MFCD01722038

FAQ

What are the physical and chemical properties of 1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2)?

1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2) is a crystalline compound with a molecular weight of approximately 214.25 g/mol. It has a solubility of about 14 g/L in water at 20°C. It is not particularly reactive under normal conditions but can react with strong acids and bases. This compound is often used in organic synthesis due to its functional groups.

How is 1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2) typically synthesized?

1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2) is usually synthesized via amination of 4-methoxybenzaldehyde with an aminooxy derivative. The reaction often uses sodium hydroxide as a base, and the yield is typically above 80%. The product is purified by recrystallization from ethanol.

What industries use 1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2)?

1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2) is primarily used in the pharmaceutical industry for the synthesis of various bioactive compounds. It is also relevant in the polymer industry for the development of functional polymers and in the sensor industry for its use in sensing devices due to its unique chemical properties.

What precautions should be taken when handling 1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2)?

When handling 1-[(Aminooxy)methyl]-4-methoxybenzene (CAS: 21038-22-2), ensure proper personal protective equipment (PPE) is worn, including gloves, goggles, and a lab coat. Store the compound in a cool, dry place, away from sources of heat and ignition. In case of a spill, use appropriate spill containment materials and reference the Safety Data Sheet (SDS) for specific cleanup procedures.