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22047-25-2,MFCD00006134
Catalog No.:AA003NL7

22047-25-2 | Acetylpyrazine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$6.00   $4.00
- +
10g
98%
in stock  
$7.00   $5.00
- +
25g
98%
in stock  
$16.00   $12.00
- +
100g
≥98%
in stock  
$46.00   $32.00
- +
500g
98%
in stock  
$157.00   $110.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003NL7
Chemical Name:
Acetylpyrazine
CAS Number:
22047-25-2
Molecular Formula:
C6H6N2O
Molecular Weight:
122.1246
MDL Number:
MFCD00006134
SMILES:
CC(=O)c1cnccn1
NSC Number:
72374
FEMA Number:
3126
Properties
Properties
 
BP:
212.9°C at 760 mmHg  
Form:
Solid  
MP:
75-78 °C  
Refractive Index:
1.5350 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
114  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.2  

Literature

Title: Aqua-[1-(pyrazin-2-yl)ethanone oximato-κ²N,N'][1-(pyrazin-2-yl)ethanone oxime-κ²N,N'](thio-cyanato-κN)nickel(II).

Journal: Acta crystallographica. Section E, Structure reports online 20120701

Title: Synthesis, Characterization and In Vitro Antibacterial Studies of Organotin(IV) Complexes with 2-Hydroxyacetophenone-2-methylphenylthiosemicarbazone (H(2)dampt).

Journal: Bioinorganic chemistry and applications 20120101

Title: Dichlorido{N-[1-(pyrazin-2-yl)ethyl-idene-κN]ethane-1,2-diamine-κN,N'}zinc.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

Title: Benzyl 3-[(E)-1-(pyrazin-2-yl)ethyl-idene]dithio-carbazate.

Journal: Acta crystallographica. Section E, Structure reports online 20110801

Title: 3-(2-Hy-droxy-phen-yl)-1-{(E)-[1-(pyrazin-2-yl)ethyl-idene]amino}-thio-urea monohydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20110401

Title: Spectroscopic and electrochemical properties of iron(II) complexes of polydentate Schiff bases containing pyrazine, pyridine and imidazole groups.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081215

Title: Identification and characterization of thiosemicarbazones with antifungal and antitumor effects: cellular iron chelation mediating cytotoxic activity.

Journal: Chemical research in toxicology 20080901

Title: (E)-2-Acetyl-pyrazine 4-nitro-phenyl-hydrazone.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: (E)-1-(3-Methoxy-phen-yl)ethanone 4-nitro-phenyl-hydrazone.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: Structure-activity relationships of novel iron chelators for the treatment of iron overload disease: the methyl pyrazinylketone isonicotinoyl hydrazone series.

Journal: Journal of medicinal chemistry 20080124

Title: 2-Acetyl-pyrazine 4-methyl-thio-semi-carbazone.

Journal: Acta crystallographica. Section E, Structure reports online 20080101

Title: Identification of potent odorants formed during the preparation of extruded potato snacks.

Journal: Journal of agricultural and food chemistry 20050810

Title: New Ag(I)-containing coordination polymers generated from multidentate Schiff-base ligands.

Journal: Inorganic chemistry 20040906

Title: How low pH can intensify beta-damascenone and dimethyl trisulfide production through beer aging.

Journal: Journal of agricultural and food chemistry 20020925

Title: Structure-activity relationship of ligands of uracil phosphoribosyltransferase from Toxoplasma gondii.

Journal: Biochemical pharmacology 19940817

Title: Li MX, et al. Cytotoxicity and structure-activity relationships of four alpha-N-heterocyclic thiosemicarbazone derivatives crystal structure of 2-acetylpyrazine thiosemicarbazone. Bioorg Med Chem Lett. 2009 May 15;19(10):2704-6.

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SDS
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Tags:22047-25-2 Molecular Formula|22047-25-2 MDL|22047-25-2 SMILES|22047-25-2 Acetylpyrazine
Catalog No.: AA003NL7
22047-25-2,MFCD00006134
22047-25-2 | Acetylpyrazine
Pack Size： 5g
Purity： 98%
in stock
$6.00 $4.00
Pack Size： 10g
Purity： 98%
in stock
$7.00 $5.00
Pack Size： 25g
Purity： 98%
in stock
$16.00 $12.00
Pack Size： 100g
Purity： ≥98%
in stock
$46.00 $32.00
Pack Size： 500g
Purity： 98%
in stock
$157.00 $110.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA003NL7
Chemical Name: Acetylpyrazine
CAS Number: 22047-25-2
Molecular Formula: C6H6N2O
Molecular Weight: 122.1246
MDL Number: MFCD00006134
SMILES: CC(=O)c1cnccn1
NSC Number: 72374
FEMA Number: 3126
Properties
BP: 212.9°C at 760 mmHg  
Form: Solid  
MP: 75-78 °C  
Refractive Index: 1.5350 (estimate)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 114  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 9  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.2  
Literature fold

Title: Aqua-[1-(pyrazin-2-yl)ethanone oximato-κ²N,N'][1-(pyrazin-2-yl)ethanone oxime-κ²N,N'](thio-cyanato-κN)nickel(II).

Journal: Acta crystallographica. Section E, Structure reports online20120701

Title: Synthesis, Characterization and In Vitro Antibacterial Studies of Organotin(IV) Complexes with 2-Hydroxyacetophenone-2-methylphenylthiosemicarbazone (H(2)dampt).

Journal: Bioinorganic chemistry and applications20120101

Title: Dichlorido{N-[1-(pyrazin-2-yl)ethyl-idene-κN]ethane-1,2-diamine-κN,N'}zinc.

Journal: Acta crystallographica. Section E, Structure reports online20111101

Title: Benzyl 3-[(E)-1-(pyrazin-2-yl)ethyl-idene]dithio-carbazate.

Journal: Acta crystallographica. Section E, Structure reports online20110801

Title: 3-(2-Hy-droxy-phen-yl)-1-{(E)-[1-(pyrazin-2-yl)ethyl-idene]amino}-thio-urea monohydrate.

Journal: Acta crystallographica. Section E, Structure reports online20110401

Title: Spectroscopic and electrochemical properties of iron(II) complexes of polydentate Schiff bases containing pyrazine, pyridine and imidazole groups.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy20081215

Title: Identification and characterization of thiosemicarbazones with antifungal and antitumor effects: cellular iron chelation mediating cytotoxic activity.

Journal: Chemical research in toxicology20080901

Title: (E)-2-Acetyl-pyrazine 4-nitro-phenyl-hydrazone.

Journal: Acta crystallographica. Section E, Structure reports online20080701

Title: (E)-1-(3-Methoxy-phen-yl)ethanone 4-nitro-phenyl-hydrazone.

Journal: Acta crystallographica. Section E, Structure reports online20080701

Title: Structure-activity relationships of novel iron chelators for the treatment of iron overload disease: the methyl pyrazinylketone isonicotinoyl hydrazone series.

Journal: Journal of medicinal chemistry20080124

Title: 2-Acetyl-pyrazine 4-methyl-thio-semi-carbazone.

Journal: Acta crystallographica. Section E, Structure reports online20080101

Title: Identification of potent odorants formed during the preparation of extruded potato snacks.

Journal: Journal of agricultural and food chemistry20050810

Title: New Ag(I)-containing coordination polymers generated from multidentate Schiff-base ligands.

Journal: Inorganic chemistry20040906

Title: How low pH can intensify beta-damascenone and dimethyl trisulfide production through beer aging.

Journal: Journal of agricultural and food chemistry20020925

Title: Structure-activity relationship of ligands of uracil phosphoribosyltransferase from Toxoplasma gondii.

Journal: Biochemical pharmacology19940817

Title: Li MX, et al. Cytotoxicity and structure-activity relationships of four alpha-N-heterocyclic thiosemicarbazone derivatives crystal structure of 2-acetylpyrazine thiosemicarbazone. Bioorg Med Chem Lett. 2009 May 15;19(10):2704-6.

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1314892-96-0
1314892-96-0
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