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Methyl 1H-pyrrole-3-carboxylate

Product Name
Methyl 1H-pyrrole-3-carboxylate
CAS No.
2703-17-5
Chemical Name
Methyl 1H-pyrrole-3-carboxylate
Synonyms
Methyl Pyrrole-3-carboxylate;EOS-61577;Methyl 3-pyrrolecarboxylate;Methyl1H-pyrrole-3-carboxylat;3-(Methoxycarbonyl)-1H-pyrrole;Methyl 1H-pyrrole-3-carboxylate;Methyl 1H-pyrrole-3-carboxylate, 95+%;Pyrrole-3-carboxylic acid methyl ester;Methyl 1H-pyrrole-3-carboxylate;1,1-dibromo-2-(chloromethyl)cyclopropane
CBNumber
CB41086094
Molecular Formula
C6H7NO2
Formula Weight
125.13
MOL File
2703-17-5.mol
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Methyl 1H-pyrrole-3-carboxylate Property

Melting point:
85-89 °C
Boiling point:
284℃
Density 
1.184
Flash point:
126℃
storage temp. 
Inert atmosphere,Room Temperature
form 
solid
pka
15.42±0.50(Predicted)
color 
Off-white to light yellow
Water Solubility 
Slightly soluble in water.
InChI
InChI=1S/C6H7NO2/c1-9-6(8)5-2-3-7-4-5/h2-4,7H,1H3
InChIKey
WLBNVSIQCFHAQB-UHFFFAOYSA-N
SMILES
N1C=CC(C(OC)=O)=C1
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Safety

Risk Statements 
36/37/38
Safety Statements 
26-37-60
WGK Germany 
3
HS Code 
29339900
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
685399
Product name
Methyl 1H-pyrrole-3-carboxylate
Purity
97%
Packaging
1g
Price
$110.25
Updated
2025/07/31
Sigma-Aldrich
Product number
685399
Product name
Methyl 1H-pyrrole-3-carboxylate
Purity
97%
Packaging
250mg
Price
$63.8
Updated
2023/06/20
TRC
Product number
M218853
Product name
Methyl 1H-pyrrole-3-carboxylate
Packaging
100mg
Price
$75
Updated
2021/12/16
Frontier Specialty Chemicals
Product number
JK807376
Product name
Methyl 1H-pyrrole-3-carboxylate
Purity
97%
Packaging
250mg
Price
$35
Updated
2021/12/16
AK Scientific
Product number
W5015
Product name
Methyl 1H-pyrrole-3-carboxylate
Packaging
5g
Price
$81
Updated
2021/12/16
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Methyl 1H-pyrrole-3-carboxylate Chemical Properties,Usage,Production

Uses

Methyl pyrrole-3-carboxylate is used as an organic chemical synthesis intermediate.

Application

A solution of methyl 1H-pyrrole-3-carboxylate (4.48 g, 35.8 mmol) in THF (70 mL) was cooled to -78 °C, N-bromosuccinimide (6.30 g, 35.4 mmol) was added, pyridine (five drops) was added, and the mixture was left standing in a freezer (-20 °C) for 3 days. The reaction mixture was concentrated under reduced pressure. Water was added to the residue, and the mixture was extracted using EtOAc. The extract was washed with brine, dried over Na2SO4, and concentrated under reduced pressure. The residue was purified by silica gel column chromatography (hexane-EtOAc = 9/1-1/1) to give Methyl 5-bromo-1H-pyrrole-3-carboxylate (3.59 g, 49percent) as a pale-yellow solid.

Synthesis

931-03-3

67-56-1

2703-17-5

The general procedure for the synthesis of methyl 3-pyrrolecarboxylate from 3-pyrrolecarboxylic acid and methanol was as follows: 1H-pyrrole-3-carboxylic acid (4.3 g, 38.7 mmol) was dissolved in methanol (40 mL) and cooled to 0-5 °C. 6N hydrochloric acid (9 mL) was added slowly, keeping the temperature at 0-5 °C. The reaction mixture was stirred at room temperature for 5 minutes and subsequently heated to reflux and kept overnight. Upon completion of the reaction, the mixture was cooled to room temperature and concentrated under reduced pressure to remove most of the solvent. The concentrate was cooled to 0 °C and saturated sodium bicarbonate solution was slowly added to adjust the pH to about 7. The mixture was extracted with ethyl acetate, the organic layers were combined and dried over anhydrous sodium sulfate. The desiccant was removed by filtration and the solvent was evaporated under reduced pressure to give methyl 1H-pyrrole-3-carboxylate as a brown solid (4 g, 83% yield). The product was confirmed by 1HNMR (400 MHz, CDCl3): δ 8.56 (broad single peak, 1H), 7.43 (single peak, 1H), 6.75 (single peak, 1H), 6.65 (single peak, 1H), 3.92 (single peak, 3H).LC-MS analysis: calculated exact mass 125.05, measured value m/z 126.2 [M + H]+.

Research

Pyrrole and Methyl 1H-Pyrrole-3-Carboxylate could be used to prepare the Soft Actuators by Electrochemical Copolymerization. In specific, a counter electrode (Ti), a reference electrode (Ag/AgCl), and a working electrode (Ti) were immersed into methyl benzoate solutions of 0.25 M of pyrrole and methyl 1-H pyrrole-3-carboxylate with 100:0, 98:2, 95:5, 80:20 mol ratios and 0.2 M N, N-diethyl-N-methyl-N-(2-methoxyethyl)ammonium bis(trifluoromethanesulfonyl) imide. The thickness of the prepared films was measured to be approximately 100 μm using a micrometer. The PPy actuator was used as the working electrode in the 1 M LiTFSI aqueous electrolyte solutions. The Py copolymer film, fabricated from pyrrole solution containing 2 and 5 mol% of methyl 1-H pyrrole-3-carboxylate, showed a reduced actuating strain of approximately 2%, but the creep strain was reduced to less than 1%[1].

References

[1] Yamasaki, Jun et al. “Soft Actuators Prepared by Electrochemical Copolymerization of Pyrrole and Methyl 1H-Pyrrole-3-Carboxylate.” 2013. 0.

Methyl 1H-pyrrole-3-carboxylate Preparation Products And Raw materials

Raw materials

Preparation Products

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Methyl 1H-pyrrole-3-carboxylate Suppliers

Accela ChemBio Co.,Ltd.
Tel
021-50795510 4000665055
Email
syeu@accelachem.com
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China
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11015
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Shanghai yirong biology science and technology co., ltd
Tel
18049974220
Fax
+86 (21) 51062076
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3060526242@qq.com
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China
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995
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Anhui Yongsheng Pharmaceutical Technology Co., Ltd
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181-3307-5798 18017383231
Email
983544897@qq.com
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China
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Alfa Aesar
Tel
400-6106006
Fax
021-67582001/03/05
Email
saleschina@alfa-asia.com
Country
China
ProdList
30123
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Energy Chemical
Tel
021-021-58432009 400-005-6266
Fax
021-58436166
Email
sales8178@energy-chemical.com
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China
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44801
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Beijing Ouhe Technology Co., Ltd
Tel
010-010-82967028 13522913783
Fax
+86-10-82967029
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2355560935@qq.com
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China
ProdList
12000
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Changzhou Huanling Chemical Co., Ltd.
Tel
0519-89803565 13776850645
Fax
0519-89803575
Email
info4@huanlingchem.com
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China
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Shanghai Hanhong Scientific Co.,Ltd.
Tel
021-54306202 13764082696
Email
info@hanhongsci.com
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China
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42934
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Tongchuang Pharma(Suzhou). Co., Ltd.
Tel
0512-63263366 18912765016
Fax
0512-6326 3366
Email
tongtf110@sina.com
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China
ProdList
993
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Shanghai Sphchem Co., Ltd.
Tel
021-56491756 13512199871
Fax
021-5649-1756
Email
2819742715@qq.com
Country
China
ProdList
4000
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View Lastest Price from Methyl 1H-pyrrole-3-carboxylate manufacturers

Career Henan Chemical Co
Product
1H-Pyrrole-3-carboxylic acid, methyl ester (9CI) 2703-17-5
Price
US $8.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
10tons
Release date
2018-12-25

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