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N-(4-butyl-2-nitrophenyl)acetamide is a chemical compound with the molecular formula C12H15N3O. It is an acetamide derivative that features a butyl group and a nitrophenyl group. N-(4-butyl-2-nitrophenyl)acetamide possesses potential biological activity, making it a candidate for pharmaceutical research and drug development. Its unique structure and properties allow for the exploration of its interactions with biological systems and possible therapeutic applications. Further investigation is required to elucidate its pharmacological and toxicological profiles and to determine its potential uses in medicine.

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  • 3663-21-6 Structure
  • Basic information

    1. Product Name: N-(4-butyl-2-nitrophenyl)acetamide
    2. Synonyms: N-(4-butyl-2-nitrophenyl)acetamide;N-(4-butyl-2-nitrophenyl)acetamide C12H16N2O3 236.27
    3. CAS NO:3663-21-6
    4. Molecular Formula: C12H16N2O3
    5. Molecular Weight: 236.26704
    6. EINECS: 222-915-6
    7. Product Categories: N/A
    8. Mol File: 3663-21-6.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 425.7 °C at 760 mmHg
    3. Flash Point: 211.3 °C
    4. Appearance: /
    5. Density: 1.18 g/cm3
    6. Vapor Pressure: 1.87E-07mmHg at 25°C
    7. Refractive Index: 1.572
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: N-(4-butyl-2-nitrophenyl)acetamide(CAS DataBase Reference)
    11. NIST Chemistry Reference: N-(4-butyl-2-nitrophenyl)acetamide(3663-21-6)
    12. EPA Substance Registry System: N-(4-butyl-2-nitrophenyl)acetamide(3663-21-6)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 3663-21-6(Hazardous Substances Data)

3663-21-6 Usage

Uses

Used in Pharmaceutical Research:
N-(4-butyl-2-nitrophenyl)acetamide is used as a research compound for studying its interactions with biological systems due to its potential biological activity and unique structural features.
Used in Drug Development:
N-(4-butyl-2-nitrophenyl)acetamide is utilized as a candidate in drug development, given its potential for therapeutic applications that require further research to understand its full pharmacological and toxicological properties.

Check Digit Verification of cas no

The CAS Registry Mumber 3663-21-6 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,6,6 and 3 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 3663-21:
(6*3)+(5*6)+(4*6)+(3*3)+(2*2)+(1*1)=86
86 % 10 = 6
So 3663-21-6 is a valid CAS Registry Number.
InChI:InChI=1/C12H16N2O3/c1-3-4-5-10-6-7-11(13-9(2)15)12(8-10)14(16)17/h6-8H,3-5H2,1-2H3,(H,13,15)

3663-21-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name N-(4-butyl-2-nitrophenyl)acetamide

1.2 Other means of identification

Product number -
Other names 3-Nitro-4-acetamino-1-butyl-benzol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3663-21-6 SDS

3663-21-6Relevant articles and documents

A Systematic Study on the Synthesis of n-Butyl Substituted 8-Aminoquinolines

Koseoglu, Ahmet,Gul, Turan,Acar, Ali Ersin

, p. 263 - 270 (2016/02/10)

(Chemical Equation Presented) A systematic study on the synthesis of 8-aminoquinoline derivatives with an n-butyl group at each alternate position of the quinoline ring was carried out. Skraup Reaction and its Doebner-von Miller variation were used to obtain most of the quinoline ring except for the 2-butyl-8-aminoquinolines and 4-butyl-8-aminoquinolines where the commercially available methylquinoline derivatives were used as precursors. The structures of the synthesized compounds were characterized by FTIR, 1H-NMR, COSY, 13C-NMR and HRMS spectra.

5-n-butyl-1H-benzotriazole synthesis process

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Paragraph 0011, (2016/12/01)

The present invention discloses a 5-n-butyl-1H-benzotriazole synthesis process, which comprises: adding concentrated sulfuric acid to acetic anhydride in a dropwise manner, and adding 4-n-butyl aniline in a dropwise manner to prepare 4-n-butyl acetanilide; adding a mixed acid solution comprising 65% concentrated nitric acid and acetic anhydride to the 4-n-butyl acetanilide in a dropwise manner to synthesize 4-n-butyl-2-nitro acetanilide; synthesizing 4-n-butyl-2-nitroaniline by using the 4-n-butyl-2-nitro acetanilide, 95% ethanol and 40% sodium hydroxide as raw materials; under the effect of a catalyst, using the 4-n-butyl-2-nitroaniline and dehydrated alcohol and sequentially using nitrogen and hydrogen to convert under a closed condition to prepare 4-n-butyl-o-phenylenediamine; and adding the 4-n-butyl-o-phenylenediamine, water and sodium nitrite to an autoclave to synthesize the 5-n-butyl-1H-benzotriazole. According to the present invention, the process equipment is simple, and the product yield is high.

Photochemistry of (2-nitrophenyl)diazomethane studied by the matrix isolation technique. (Nitrophenyl)carbene to (carboxylphenyl)nitrene rearrangement by successive reduction of the nitro group with the carbenic center

Tomioka, Hideo,Ichikawa, Naoki,Komatsu, Kazunori

, p. 8045 - 8053 (2007/10/02)

Irradiation (λ > 350 nm) of (2-nitrophenyl)diazomethane (1) matrix-isolated in Ar at 10 K provided 2-nitrosobenzaldehyde (3) presumably as a result of intramolecular oxygen migration in (2-nitrophenyl)carbene (2). Upon further irradiation (λ > 350 nm), 3 was decomposed to give a mixture of 2,1-benzisoxazol-3(1H)-one (4) and carbonylcyclopentadiene imine (5) along with CO2. The oxazolone (4) underwent decarboxylation to give 5 upon irradiation with shorter wavelength light (λ > 300 nm) but not at longer wavelength (λ > 350 nm), suggesting 4 is not the direct precursor for 5 in the photolysis of 3. Irradiation (λ > 350 nm) of (4-n-butyl-2-nitrophenyl)diazomethane (1b) under similar conditions resulted in the formation of carbonyloximinocyclohexadienylidene (7) which then produced the oxazolone (4b) and the imine (5b) upon further irradiation, suggesting that a 1,4-biradical generated as a result of abstraction of H at the ortho position by the photoexcited nitroso group was involved in the reaction of 3 forming 4. (2-Carboxyphenyl)nitrene (9) generated by 1,4-OH shift in the 1,4-biradical was postulated as an intermediate leading to 5, and this was actually demonstrated by independent generation of 9 by the photolysis of 2-azidobenzoic acid (8).

Nouveaux diamino-3,4 phenylalcanes et leur transformation en benzimidazolemethanethiols-2

Krati, Noureddine,Roizard, Denis,Brembilla, Alain,Lochon, Pierre

, p. 443 - 448 (2007/10/02)

We report five o-phenylenediamines which are substituted by an aliphatic chain containing n carbon atoms (n = 4, 6, 8, 10, 12).We describe a well adapted general synthetic method using Schmidt's reaction.The diamines were then transformed into 2-benzimidazolemethanethiols and their related S-methyl derivatives which structures were checked by (1)H NMR.

Treatment of helminth infections with substituted phenyl-thiourea derivatives

-

, (2008/06/13)

Benzene derivatives of the formula:- STR1 wherein R is an aliphatic hydrocarbon group of 1 to 4 carbon atoms optionally substituted by halogen or alkoxy, R1 is hydrogen or methyl, R2 is hydrogen, halogen, alkyl, alkanoylamino optionally substituted by cycloalkyl of 3 to 6 carbon atoms, alkoxycarbonylamino, alkanoyl, benzoyl or N-methylmethanesulphonylamino, and Y is primary amino or substituted amino, possess anthelmintic and anti-viral activity. New compounds within that formula possess fungicidal properties.

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