13916-39-7

Basic information

• Product Name: 2-CHLORO-N-PROPYLACETAMIDE
• Synonyms: OTAVA-BB BB7020410083;AKOS BBS-00006591;2-CHLORO-N-PROPYLACETAMIDE;acetamide, 2-chloro-N-propyl-;2-chloro-N-propylacetamide(SALTDATA: FREE);2-chloro-N-propyl-ethanamide;alpha-chloro-n-propylacetamide
• CAS NO: 13916-39-7
• Molecular Formula: C₅H₁₀ClNO
• Molecular Weight: 135.59
• Mol File: 13916-39-7.mol
• Article Data: 26

Chemical Properties

• Boiling Point: 260.1 °C at 760 mmHg
• Flash Point: 111.1 °C
• Appearance: Colorless transparent liquid
• Density: 1.056g/cm³
• Vapor Pressure: 0.0125mmHg at 25°C
• Refractive Index: 1.437
• CAS DataBase Reference: 2-CHLORO-N-PROPYLACETAMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLORO-N-PROPYLACETAMIDE(13916-39-7)
• EPA Substance Registry System: 2-CHLORO-N-PROPYLACETAMIDE(13916-39-7)

Safety Data

• Hazard Codes: Xn
• Statements: 22
• HazardClass: IRRITANT
• Hazardous Substances Data: 13916-39-7(Hazardous Substances Data)

Usage

General Description

2-Chloro-N-propylacetamide, also known as N-Propyl-2-chloroacetamide, is a chemical compound with the molecular formula C5H10ClNO. It is a clear, colorless liquid that is commonly used as an intermediate in the synthesis of pharmaceuticals and other organic compounds. This chemical is classified as an amide, containing both an amine and a carboxyl group, and the chloro group in its structure contributes to its reactivity in various reactions. Due to its versatile nature, 2-Chloro-N-propylacetamide is utilized in the production of a variety of drugs and organic compounds. Additionally, it can also be used as a solvent or a reagent in chemical reactions. Safety precautions should be taken when handling this chemical as it can be harmful if ingested, inhaled, or in contact with the skin.

InChI:InChI=1/C5H10ClNO/c1-2-3-7-5(8)4-6/h2-4H2,1H3,(H,7,8)

Upstream product

• 107-10-8 propylamine 
• 4960-82-1 dichlorodiacetamide 
• 79-04-9 chloroacetyl chloride 
• 7572-29-4 dichloroethyne 
• 556-53-6 N-propylamine hydrochloride 

Downstream Products

• 100370-83-0 N-propyl-2-(4-methylphenyl)sulfonylacetamide 
• 36160-74-4 2-[Isopropyl-(toluene-4-sulfinyl)-amino]-N-propyl-acetamide 
• 59716-75-5 N-Propyl-S-(4,5-diphenyloxazol-2-yl)-mercaptoacetamid 
• 91907-53-8 N-Methyl-N-phenyl-glycin-propylamid 
• 76810-30-5 C₁₂H₁₆N₂O₂ 
• 106231-51-0 Benzoic acid propylcarbamoylmethyl ester 
• 163629-03-6 1-(n-propylaminocarbonylmethyl)-2-phenyl-indole 
• 642486-01-9 5-methyl-4-phenyl-1-propyl-1,3-dihydro-pyrrol-2-one 
• 735318-84-0 2-(3-trifluoromethyl-phenylamino)nicotinic acid propylcarbamoylmethyl ester 
• 642486-06-4 5-methyl-4-phenyl-1-propyl-1,5-dihydro-pyrrol-2-one 
• 86562-23-4 (+/-)-3-(3-methoxyphenyl)-N-n-propylpiperidine 
• 344257-61-0 3-(4-methoxyphenyl)-1-propylpiperidine 
• 126088-53-7 3-(3-methoxyphenyl)-1-propyl-2-piperidinone 
• 19748-93-7 1-propyl-3-phenyl-piperidine 

Relevant articles and documents

1-(Carbamoylmethyl)-3H-indolium squaraine dyes: Synthesis, spectra, photo-stability and association with BSA

Novel, squarylium dyes containing 1-(alkylcarbamoylmethyl)-2,3,3-trimethyl- 3H-indolium groups were synthesized and their UV/Vis and fluorescence spectra, aggregation, photo-stability and association with bovine serum albumin were studied. The absorption and emission max wavelengths of the dyes in different solvents were in the range 619-653?nm. Compared to a typical ethyl squarylium dye, the introduction of alkylcarbamoylmethyl groups reduced aggregation and improved molar extinction coefficient, fluorescence quantum yield and photo-stability in water. Moreover, the fluorescence intensity of the dyes increased upon the addition of BSA in pH 7.0 phosphate buffer solution. An excellent linear relationship (r2?=?0.9982) was obtained between fluorescence intensity and bovine serum albumin concentration.

Synthesis and Biological Evaluation of 1,2,4-Triazole Thioethers as Both Potential Virulence Factor Inhibitors against Plant Bacterial Diseases and Agricultural Antiviral Agents against Tobacco Mosaic Virus Infections

Targeting the virulence factors of phytopathogenic bacteria is an innovative strategy for alleviating or eliminating the pathogenicity and rapid outbreak of plant microbial diseases. Therefore, several types of 1,2,4-triazole thioethers bearing an amide l

Synthesis of E/Z N-(1-Chlorovinyl)formamide Using Vilsmeier–Haack Reaction

Synthesis of a variety of novel Z/E N-(1-chlorovinyl)formamides through Vilsmeier–Haack reaction starting from 2-phenoxyethanamides with POCl3/DMF has been accomplished. The reactions introduced chlorine atom to the Cα-position and p

Synthesis and acaricidal activities of scopoletin phenolic ether derivatives: Qsar, molecular docking study and in silico Adme predictions

Thirty phenolic ether derivatives of scopoletin modified at the 7-hydroxy position were synthesized, and their structures were confirmed by IR,1H-NMR,13C-NMR, MS and elemental analysis. Preliminary acaricidal activities of these compounds against female adults of Tetranychus cinnabarinus (Boisduval) were evaluated using the slide-dip method. The results indicated that some of these compounds exhibit more pronounced acaricidal activity than scopoletin, especially compounds 32, 20, 28, 27 and 8 which exhibited about 8.41-, 7.32-, 7.23-, 6.76-, and 6.65-fold higher acaricidal potency. Compound 32 possessed the the most promising acaricidal activity and exhibited about 1.45-fold higher acaricidal potency against T. cinnabarinus than propargite. Statistically significant 2D-QSAR model supports the observed acaricidal activities and reveals that polarizability (HATS5p) was the most important parameter controlling bioactivity. 3D-QSAR (CoMFA: q2 = 0.802, r2 = 0.993; CoMSIA: q2 = 0.735, r2 = 0.965) results show that bulky substituents at R4, R1, R2 and R5 (C6, C3, C4, and C7) positions, electron positive groups at R5 (C7) position, hydrophobic groups at R1 (C3) and R2 (C4), H-bond donors groups at R1 (C3) and R4 (C6) will increase their acaricidal activity, which provide a good insight into the molecular features relevant to the acaricidal activity for further designing novel acaricidal agents. Molecular docking demonstrates that these selected derivatives display different bide modes with TcPMCA1 from lead compound and they interact with more key amino acid residues than scopoletin. In silico ADME properties of scopoletin and its phenolic ether derivatives were also analyzed and showed potential to develop as good acaricidal candidates.