Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate | CAS No. 161798-01-2

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate

Basic Information

CAS Number

161798-01-2

Molecular Formula

C14H13NO4S

Molecular Weight

291.33 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

113.0 to 117.0 deg-C

Boiling Point

446.7°C at 760 mmHg

CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)O)C=O)C

InChI

InChI=1S/C14H13NO4S/c1-3-19-14(18)12-8(2)15-13(20-12)9-4-5-11(17)10(6-9)7-16/h4-7,17H,3H2,1-2H3

InChIKey

NJRGQNNSIAFIJC-UHFFFAOYSA-N

LogP

2.813320000000001

Topological Polar Surface Area

76.49 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

365

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H332 Harmful if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • NS00003879
  • Ethyl2-(3-formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylate
  • FT-0657500
  • Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylate
  • Q-103512
  • SY110916
  • E1394
  • ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl thiazole-5-carboxylate
  • A3587
  • 161798-01-2
  • 5-Thiazolecarboxylicacid, 2-(3-formyl-4-hydroxyphenyl)-4-methyl-, ethyl ester
  • BCP23103
  • AKOS015897623
  • NJRGQNNSIAFIJC-UHFFFAOYSA-N
  • MFCD13194810
  • 5-Thiazolecarboxylic acid, 2-(3-formyl-4-hydroxyphenyl)-4-methyl-, ethyl ester
  • ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate
  • CS-W022643
  • ethyl-2-(3-formyl-4-hydroxyphenyl)-4-methyl-5-thiazole carboxylate
  • AM20090757
  • AC-5909
  • 2-(3-formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylic acid ethyl ester
  • Febuxostat Impurity 1
  • EC 692-179-2
  • DS-1887
  • DTXSID901138017
  • SCHEMBL454793
  • 2-(3-formyl-4-hydroxyphenyl)-4-methyl-5-Thiazolecarboxylic acid ethyl ester
  • Febuxostat Intermediate II
  • 2-(3-Formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylic Acid Ethyl Ester
  • Febuxostat PI-2

MDL Number

MFCD13194810

Customs Code

2934100090

FAQ

What is Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate (CAS: 161798-01-2)?

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate is an organic compound with the CAS number 161798-01-2. It belongs to the thiazole class and contains functional groups such as formyl, hydroxy, and carboxylate. This compound is known for its potential applications in medicinal chemistry and is often used as an intermediate in the synthesis of various pharmaceuticals. It is typically a solid at room temperature and has moderate solubility in organic solvents.

What are the main uses of Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate (CAS: 161798-01-2)?

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate is primarily used in pharmaceutical research as a key intermediate in the development of drugs. It may also find applications in organic synthesis, chemical manufacturing, and as a building block for bioactive compounds. Its unique structure makes it valuable in the design of molecules with therapeutic potential, particularly in anti-inflammatory and antimicrobial drug development.

Is Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate (CAS: 161798-01-2) safe?

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate is generally considered safe when handled properly. However, as with many chemical compounds, it should be treated with caution. It is advisable to use appropriate personal protective equipment (PPE) such as gloves and goggles. Safety data sheets (SDS) recommend avoiding inhalation and skin contact, and ensuring good ventilation during handling. It is not classified as highly toxic, but standard chemical safety protocols should be followed.

How should Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate (CAS: 161798-01-2) be stored?

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate should be stored in a cool, dry, and well-ventilated place, away from light. It is best kept in a sealed container at a temperature below 25°C to maintain stability. Avoid exposure to moisture and incompatible substances. Proper storage helps preserve its chemical integrity and prolongs its shelf life.

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