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(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER

Product Name
(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER
CAS No.
82668-50-6
Chemical Name
(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER
Synonyms
Ethyl 2-(1H-pyrazol-3-yl)acetate;Ethyl 2-(1H-pyrazol-3-yl);Ethyl 2-(3-Pyrazolyl)acetate;ethyl 2-(1H-pyrazol-5-yl)acetate;1H-Pyrazole-3-acetic acid ethyl ester;(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER;(2H-Pyrazol-3-yl)-acetic acid ethyl ester
CBNumber
CB51870720
Molecular Formula
C7H10N2O2
Formula Weight
154.17
MOL File
82668-50-6.mol
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(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER Property

Boiling point:
106 °C(Press: 0.4 Torr)
Density 
1.183±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
pka
13.44±0.10(Predicted)
Appearance
Colorless to light yellow Liquid
InChI
InChI=1S/C7H10N2O2/c1-2-11-7(10)5-6-3-4-8-9-6/h3-4H,2,5H2,1H3,(H,8,9)
InChIKey
MZLKPCAZQWMXFD-UHFFFAOYSA-N
SMILES
N1C=CC(CC(OCC)=O)=N1
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H226Flammable liquid and vapour

Precautionary statements

P210Keep away from heat/sparks/open flames/hot surfaces. — No smoking.

P233Keep container tightly closed.

P240Ground/bond container and receiving equipment.

P241Use explosion-proof electrical/ventilating/lighting/…/equipment.

P242Use only non-sparking tools.

P243Take precautionary measures against static discharge.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

P370+P378In case of fire: Use … for extinction.

P403+P235Store in a well-ventilated place. Keep cool.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TRC
Product number
P842260
Product name
(1H-Pyrazol-3-yl)-aceticacidethylester
Packaging
50mg
Price
$110
Updated
2021/12/16
AK Scientific
Product number
8330AH
Product name
(1H-Pyrazol-3-yl)aceticacidethylester
Packaging
250mg
Price
$227
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
CHM0385478
Product name
(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER
Purity
95.00%
Packaging
5MG
Price
$504.45
Updated
2021/12/16
Ambeed
Product number
A122469
Product name
Ethyl2-(3-Pyrazolyl)acetate
Purity
95%
Packaging
100mg
Price
$55
Updated
2021/12/16
Ambeed
Product number
A122469
Product name
Ethyl2-(3-Pyrazolyl)acetate
Purity
95%
Packaging
250mg
Price
$79
Updated
2021/12/16
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(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER Chemical Properties,Usage,Production

Synthesis

64-17-5

102732-63-8

82668-50-6

General procedure for the synthesis of ethyl (1H-pyrazol-3-yl)acetate from ethanol and 2-(1H-pyrazol-3-yl)acetic acid: 2-(1H-pyrazol-3-yl)acetic acid (4.0 g, 32 mmol) was dissolved in a solution of ethanol (100 mL) containing concentrated HCl, and H2SO4 (1.0 mL) was added as catalyst. The reaction mixture was heated to reflux overnight. After completion of the reaction, the reaction solution was concentrated and the residue was neutralized with aqueous NaHCO3. The aqueous phase was extracted with ethyl acetate and the organic phase was dried with Na2SO4. The solvent was removed under reduced pressure to give ethyl (1H-pyrazol-3-yl)acetate (4.6 g, 94% yield) as a brown oil.LC-MS (ESI): m/z = 155 (M + H)+.

References

[1] Patent: WO2013/164321, 2013, A1. Location in patent: Page/Page column 39

(1H-PYRAZOL-3-YL)ACETIC ACID ETHYL ESTER Preparation Products And Raw materials

Raw materials

Preparation Products

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