N-(2,5-Dimethoxyphenyl)-3-oxobutanamide

Basic Information

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CAS Number

6375-27-5

Molecular Formula

C12H15NO4

Molecular Weight

237.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

71.0 to 75.0 deg-C

Boiling Point

410 ℃ at 760 mmHg

SMILES

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CC(=O)CC(=O)NC1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C12H15NO4/c1-8(14)6-12(15)13-10-7-9(16-2)4-5-11(10)17-3/h4-5,7H,6H2,1-3H3,(H,13,15)

InChIKey

PJFIAKRRJLGWMD-UHFFFAOYSA-N

LogP

1.6214

Topological Polar Surface Area

64.63 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

280

Synonyms & References

English

CAS-6375-27-5
Acetoacetanilide, 2',5'-dimethoxy-
N-(2,5-dimethoxyphenyl)-3-oxo-butyramide
N-(2,5-dimethoxyphenyl)-3-oxobutanamide
6375-27-5
CHEMBL3182874
NSC50634
Butanamide, N-(2,5-dimethoxyphenyl)-3-oxo-
MFCD00043930
NCGC00256217-01
Z56887788
Acetoacet-2,5-dimethoxyanilide
2',5'-Dimethoxyacetoacetanilide
UNII-T6ELE0Q76F
NS00035548
W-104880
D5584
Tox21_302213
Acetoacetyl-2,5-dimethoxyanilide
DTXCID6024709
Q27289737
AB00078259-01
8R-0028
NSC-50634
A834504
AKOS000115206
CS-0218594
EN300-01448
2,5-Dimethoxyacetoacetanilide
D90410
2,5-Dimethoxy acetoacetanilide

MDL Number

MFCD00043930

Customs Code

2924299090

FAQ

What are the physical and chemical properties of N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5)?

N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5) is a white to off-white crystalline solid with a molecular weight of approximately 246.32 g/mol. It is slightly soluble in water but more soluble in common organic solvents like methanol and dichloromethane. The compound is moderately reactive towards nucleophiles and can undergo amide hydrolysis. It is stable under normal storage conditions but should be protected from strong acids and bases.

How is N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5) typically synthesized?

N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5) is typically synthesized via the condensation of 2,5-dimethoxybenzaldehyde with acetamide in the presence of a suitable catalyst such as p-toluenesulfonic acid (p-TSA). The reaction involves the formation of an intermediate imine, which is then cyclized to form the desired amide. The yield is generally high, and the reaction is selective under mild conditions.

What industries use N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5)?

N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5) is used in various industries, including pharmaceuticals, where it serves as an intermediate in the synthesis of certain drugs. It is also used in the production of polymers and as a building block in the development of sensors and semiconductors.

What precautions should be taken when handling N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5)?

When handling N-(2,5-Dimethoxyphenyl)-3-oxobutanamide (CAS: 6375-27-5), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The material should be stored in a fume hood to avoid inhalation of vapors. In case of a spill, it should be carefully cleaned up and disposed of according to local regulations. Always consult the Material Safety Data Sheet (MSDS) for detailed safety information.