CAS 2999-46-4

Ethyl isocyanoacetate

Description:

Ethyl isocyanoacetate, with the CAS number 2999-46-4, is an organic compound characterized by its isocyanate functional group attached to an ethyl ester. It typically appears as a colorless to pale yellow liquid with a distinctive odor. This compound is known for its reactivity, particularly in nucleophilic addition reactions, making it valuable in organic synthesis, especially in the preparation of various nitrogen-containing compounds. Ethyl isocyanoacetate is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic ethyl group. It is important to handle this substance with care, as it can be toxic and may cause irritation upon contact with skin or mucous membranes. Additionally, it is sensitive to moisture and should be stored in a dry environment to prevent hydrolysis. Overall, ethyl isocyanoacetate serves as a useful intermediate in the synthesis of pharmaceuticals and agrochemicals, showcasing its significance in the field of organic chemistry.

Formula: C₅H₇NO₂

InChI: InChI=1S/C5H7NO2/c1-3-8-5(7)4-6-2/h3-4H2,1H3

InChI key: InChIKey=FPULFENIJDPZBX-UHFFFAOYSA-N

SMILES: C(C[N+]#[C-])(OCC)=O

Synonyms:

• (Ethoxycarbonyl)methyl isonitrile
• 2-Ethoxy-2-oxoethyl isocyanide
• 2-Ethyloxycarbonylmethyl isocyanide
• 2-Isocyanobutanoate
• Acetic acid, 2-isocyano-, ethyl ester
• Acetic acid, isocyano-, ethyl ester
• Ethoxycarbonylmethyl isocyanide
• Ethyl 2-isocyanoacetate
• Ethyl α-isocyanoacetate
• Isocyanoacetic acid ethyl ester
• α-Isocyanoacetic acid ethyl ester

Ethyl Isocyanoacetate

CAS: 2999-46-4

Formula: C₅H₇NO₂

Purity: >97.0%(GC)

Color and Shape: Colorless to Brown clear liquid

Molecular weight: 113.12

Ref: 3B-I0562

Ethyl isocyanoacetate, 98%

CAS: 2999-46-4

Ethyl isocyanoacetate is used in the syntheses of 7-aza-tetrahydroindoles, oxazolines, benzodiazepines, imidazoles and oxazoles. For example, it is involved in the synthesis of 1H-indole-2-carboxylate by condensing with 2-bromo benzenealdehyde using CuI as a catalyst. It is a precursor used in the p

Formula: C₅H₇NO₂

Purity: 98%

Color and Shape: Liquid, Clear colorless to dark brown

Molecular weight: 113.12

Ref: 02-L15379

Ethyl isocyanoacetate

CAS: 2999-46-4

Ethyl isocyanoacetate

Formula: C₅H₇NO₂

Purity: 95%

Color and Shape: clear. very dark orange liquid

Molecular weight: 113.11g/mol

Ref: 54-OR18110

Ethyl isocyanoacetate

CAS: 2999-46-4

Formula: CNCH₂CO₂CH₂CH₃

Molecular weight: 113.12

Ref: 7W-GK9736

Ethyl isocyanoacetate

CAS: 2999-46-4

Formula: C₅H₇NO₂

Purity: 98.0%

Color and Shape: Liquid, Clear Liquid

Molecular weight: 113.116

Ref: 10-F358365

Ethyl Isocyanoacetate

CAS: 2999-46-4

Formula: C₅H₇NO₂

Color and Shape: Neat

Molecular weight: 113.11

Ref: TR-E921325

Ethyl-2-isocyanoacetate

CAS: 2999-46-4

Ethyl-2-isocyanoacetate is a chemical substance that is used in organic chemistry as a reagent for the synthesis of esters and amides. It has been shown to have strong antimicrobial activity against bacteria, including methicillin-resistant Staphylococcus aureus. This compound has also been shown to inhibit the growth of skin cancer cells, which may be due to its ability to induce apoptosis. Ethyl-2-isocyanoacetate reacts with nitro groups in proteins and amino acids by replacement of an oxygen atom from the hydroxyl group with a nitrogen atom from the carboxylic acid group. This reaction mechanism is catalyzed by ns3 protease, which is activated by hydrogen peroxide and thioredoxin reductase.

Formula: C₅H₇NO₂

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 113.11 g/mol

Ref: 3D-FE32404