Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester

Basic Information

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CAS Number

39562-22-6

Molecular Formula

C14H15NO6

Molecular Weight

293.27 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 Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

72-74 ºC

Boiling Point

433.4℃/760mmHg

SMILES

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CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)OCCOC

InChI

InChI=1S/C14H15NO6/c1-10(16)13(14(17)21-7-6-20-2)9-11-4-3-5-12(8-11)15(18)19/h3-5,8-9H,6-7H2,1-2H3/b13-9+

InChIKey

UVZJPCAZMGLNTB-UKTHLTGXSA-N

LogP

2.28000

Complexity

426

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

BCP21153
2-Methoxyethyl 2-(3-Nitrobenzylidene)-3-oxobutyrate
MFCD00521048
2-Methoxyethyl (2E)-2-acetyl-3-(3-nitrophenyl)-acrylate
2-methoxyethyl 2-[(3-nitrophenyl)methylene]acetoacetate
39562-22-6
2-Methoxyethyl 2-(m-Nitrobenzylidene)acetoacetate
2-Methoxyethyl 2-(3-nitrobenzylidene)-3-oxobutanoate
Z46069648
2-METHOXYETHYL 2-ACETYL-3-(3-NITROPHENYL)ACRYLATE
2-Methoxyethyl 2-((3-nitrophenyl)methylene)acetoacetate
Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethyl ester
SR-01000026425-1
2-methoxyethyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate
Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester
85677-91-4
2-Methoxyethyl2-(3-Nitrobenzylidene)-3-oxobutyrate
SR-01000026425
CS-0155156
EINECS 254-511-0
AKOS005174927
(E)-2-methoxyethyl 2-(3-nitrobenzylidene)-3-oxobutanoate
2-METHOXYETHYL 2-(3-NITROBENZYLIDENE)ACETOACETATE
2-methoxyethyl (2E)-2-acetyl-3-(3-nitrophenyl)acrylate
2-methoxyethyl (E)-2-(3-nitrobenzylidene)-3-oxobutanoate
2-Methoxyethyl 2-[(3-nitrophenyl)methylene]acetoacetate
2-Methoxyethyl 2-(3-Nitrobenzylidene)acetoacetate
METHOXYETHYL 3-NITROBENZYLIDENACETOACETATE
2-Methoxyethyl (2Z)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate

MDL Number

MFCD00521048

Customs Code

2918300090

FAQ

What is Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6)?

Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6) is a derivative of butyric acid, containing a nitrophenyl and methoxyethyl ester functional group. It is a colorless to pale yellow liquid with a pungent odor.

What are the main uses of Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6)?

This compound is primarily used in pharmaceuticals as an intermediate in the synthesis of various organic compounds. It also finds application in the preparation of dyes and as a reagent in research and analytical chemistry.

Is Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6) safe?

Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6) is generally safe for use, but precautions should be taken. It is corrosive and can cause skin and eye irritation. Proper protective equipment and handling procedures should be followed.

How should Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6) be stored?

Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, 2-methoxyethylester (CAS: 39562-22-6) should be stored in a cool, dry place, away from heat and sources of ignition. It should be kept in a tightly sealed container, protected from light and stored in a well-ventilated area. Temperature should be maintained at room temperature or lower to prevent degradation.