4-Formyl-N-isopropylbenzamide

Basic Information

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CAS Number

13255-50-0

Molecular Formula

C11H13NO2

Molecular Weight

191.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

124-127°C

Boiling Point

367.8°Cat760mmHg

Flash Point

157.6°C

Refractive Index

1.551

SMILES

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CC(C)NC(=O)C1=CC=C(C=C1)C=O

InChI

InChI=1S/C11H13NO2/c1-8(2)12-11(14)10-5-3-9(7-13)4-6-10/h3-8H,1-2H3,(H,12,14)

InChIKey

OMFHZDXZIJJKFP-UHFFFAOYSA-N

LogP

1.6373

Topological Polar Surface Area

46.17 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

205

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

EINECS 236-247-8
N-Isopropyl-4-formylbenzamide
4-Carboxaldehyde-N-isopropylbenzamide
n-isopropyl-p-formylbenzamide
5-(METHYLSULFANYL)-2-THIENYLBORONICACID
SCHEMBL5576499
FT-0697557
13255-50-0
2NMQ4M6QG3
SY101992
82239-62-1
AB16510
UNII-2NMQ4M6QG3
CS-W022186
4-formyl-N-propan-2-ylbenzamide
4-FORMYL-N-(PROPAN-2-YL)BENZAMIDE
CHEMBL3561363
BCP08148
AMY25462
4-formyl-N-isopropyl-benzamide
4-Formyl-N-isopropylbenzamide
AKOS006240036
DS-1134
MFCD03840703
OMFHZDXZIJJKFP-UHFFFAOYSA-N
Terephthalaldehydamide, N-isopropyl-
AC-29963
N-Isopropyl-4-formylbenzamide; N-Isopropyl-p-formylbenzamide; N-Isopropylterephthalaldehydamide; 4-Formyl-N-(1-methylethyl)benzamide;
DTXSID9057636
A888279
Benzamide, 4-formyl-N-(1-methylethyl)-

MDL Number

MFCD03840703

Customs Code

2924299090

FAQ

What regulatory guidelines apply to 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0)?

4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) falls under the scope of the REACH regulation in the European Union, which requires suppliers to register the substance if its annual tonnage exceeds certain thresholds. In the United States, the FDA regulates the use of pharmaceuticals, and the EPA oversees environmental and safety aspects. Additionally, the GHS provides a framework for classifying and labeling hazardous chemicals, which should be followed for proper handling and storage.

Are there alternatives to 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) in synthesis?

Alternatives to 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) include other aromatic compounds such as 4-formylbenzamide and its isomers. In some cases, similar functionalities can be introduced using different aromatic scaffolds or through the use of analogous reagents like 4-formyl-N-ethylbenzamide or 4-formyl-N-methylbenzamide. These alternatives can offer similar chemical properties but with varying reactivity and solubility characteristics.

What is the market or research trend for 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0)?

The market for 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) is steadily growing, particularly in the pharmaceutical and chemical industries. Research trends indicate a focus on developing new derivatives and exploring their potential in drug discovery and synthesis. The compound is also being studied for its applications in materials science and as a precursor for various organic transformations. Market demand is influenced by its reactivity and unique chemical properties.

How should waste containing 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) be handled?

Waste containing 4-Formyl-N-isopropylbenzamide (CAS: 13255-50-0) should be handled according to local regulations and best practices for hazardous waste management. Collection should be done in suitable containers to prevent leakage. Professional waste disposal services should be utilized for incineration or other appropriate methods. It is important to ensure that waste is treated to minimize environmental impact and to comply with environmental protection regulations.