Cas no 881674-29-9 (methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate)
Methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate is a brominated pyrrole derivative with a methyl ester functional group, serving as a versatile intermediate in organic synthesis. Its key structural features—a bromine substituent and a methyl ester—make it valuable for further functionalization, particularly in heterocyclic chemistry and pharmaceutical research. The compound’s reactivity allows for selective cross-coupling reactions, such as Suzuki or Stille couplings, facilitating the construction of complex pyrrole-based scaffolds. The methyl ester group also provides a handle for hydrolysis or transesterification, enabling downstream modifications. This compound is particularly useful in medicinal chemistry for the development of bioactive molecules, owing to its well-defined reactivity and stability under standard synthetic conditions.
881674-29-9 structure
Product Name:methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate
CAS No:881674-29-9
MF:C7H8BrNO2
MW:218.047921180725
CID:1916997
PubChem ID:66924763
Update Time:2025-06-09
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole-3-carboxylic acid, 5-bromo-4-methyl-, methyl ester
- methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate
- MLKAVNNWGFMCSZ-UHFFFAOYSA-N
- EN300-1628559
- Methyl5-bromo-4-methyl-1H-pyrrole-3-carboxylate
- SCHEMBL1156403
- DB-370937
- AT33807
- CS-0457779
- 881674-29-9
-
- Inchi： 1S/C7H8BrNO2/c1-4-5(7(10)11-2)3-9-6(4)8/h3,9H,1-2H3
- InChI Key： MLKAVNNWGFMCSZ-UHFFFAOYSA-N
- SMILES： BrC1=C(C)C(C(=O)OC)=CN1
Computed Properties
- Exact Mass: 216.97384Da
- Monoisotopic Mass: 216.97384Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 163
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 42.1?2
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-1628559-0.05g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 0.05g |
$1056.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-0.1g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 0.1g |
$1106.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-0.25g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 0.25g |
$1156.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-0.5g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 0.5g |
$1207.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-1.0g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 1g |
$1256.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-2.5g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 2.5g |
$2464.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-5.0g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 5g |
$3645.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-10.0g |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 10g |
$5405.0 | 2023-06-04 | ||
| Enamine | EN300-1628559-50mg |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 50mg |
$1056.0 | 2023-09-22 | ||
| Enamine | EN300-1628559-100mg |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate |
881674-29-9 | 100mg |
$1106.0 | 2023-09-22 |
methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate Related Literature
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
881674-29-9 (methyl 5-bromo-4-methyl-1H-pyrrole-3-carboxylate) Related Products
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
