3,5-Dimethyl-1,2-oxazole-4-carbaldehyde

Basic Information

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CAS Number

54593-26-9

Molecular Formula

C6H7NO2

Molecular Weight

125.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

54-56°C

Boiling Point

73°C/5mmHg

Density

1.14

Flash Point

96.4 °C

Refractive Index

1.514

SMILES

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CC1=C(C(=NO1)C)C=O

InChI

InChI=1S/C6H7NO2/c1-4-6(3-8)5(2)9-7-4/h3H,1-2H3

InChIKey

TVAYXKLCEILMEA-UHFFFAOYSA-N

LogP

1.10394

Topological Polar Surface Area

43.1 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

116

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

3,5-dimethylisoxazole-4-carbaldehyde
CS-W002952
54593-26-9
PS-4243
NSC151753
3,5-Dimethyl-4-Isoxazolecarbaldehyde
J-511348
3,5-dimethyl-isoxazole-4-carbaldehyde
SCHEMBL96416
NSC-151753
3,5-DIMETHYLISOXAZOL-4-CARBOXALDEHYDE
3,5-DIMETHYLISOXAZOLE-4-CARBOXALDEHYDE
3,5-dimethyl-4-isoxazolecarbaldehyde, AldrichCPR
AMY23011
EN300-09266
SY019252
3,5-DIMETHYL-4-FORMYLISOXAZOLE
AB12163
TVAYXKLCEILMEA-UHFFFAOYSA-N
A22536
BB 0255051
FT-0614675
DTXSID90302520
3,5-DIMETHYL-4-ISOXAZOLECARBOXALDEHYDE
D4682
3,5-dimethylisoxazol-4-carbaldehyde
AKOS000264823
3,5-dimethyl-1,2-oxazole-4-carbaldehyde
MFCD02681977
4-Isoxazolecarboxaldehyde, 3,5-dimethyl-
Z56346920

MDL Number

MFCD02681977

Customs Code

2934999090

FAQ

What is 3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9)?

3,5-Dimethyl-1,2-oxazole-4-carbaldehyde is a chemical compound with the CAS number 54593-26-9. It has the chemical formula C6H8NO2 and is a colorless to white crystalline solid. This compound is characterized by its pungent odor and is used in various applications such as pharmaceuticals and research due to its unique chemical properties.

What are the main uses of 3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9)?

3,5-Dimethyl-1,2-oxazole-4-carbaldehyde is primarily used in pharmaceuticals for the synthesis of certain drugs and in chemical research as a reagent due to its reactive functionality. It is also utilized in the preparation of other organic compounds and as a functional group in organic synthesis.

Is 3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9) safe?

3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9) is generally considered safe when used in proper conditions, but it is important to follow safety guidelines. It is flammable and should be handled with caution. Proper protective measures, such as wearing gloves and goggles, should be taken to prevent skin and eye contact. Storage should be in a cool, well-ventilated area away from heat sources.

How should 3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9) be stored?

3,5-Dimethyl-1,2-oxazole-4-carbaldehyde (CAS: 54593-26-9) should be stored in a cool, well-ventilated area away from heat sources and direct sunlight. It should be kept in a well-sealed, airtight container to prevent exposure to air and moisture. The storage temperature should be below 25°C (77°F) to ensure its stability and safety. Regular checks should be made to ensure the seal is intact and the container is not compromised.