5-BROMOMETHYL-3-METHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER

Modify Date: 2026-07-01 12:22:53

5-BROMOMETHYL-3-METHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER structure	Common Name	5-BROMOMETHYL-3-METHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER
	CAS Number	57745-26-3	Molecular Weight	318.16400
	Density	1.431g/cm3	Boiling Point	450.2ºC at 760 mmHg
	Molecular Formula	C₁₂H₁₆BrNO₄	Melting Point	N/A
	MSDS	N/A	Flash Point	226.1ºC

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name	diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate
Synonym	More Synonyms

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density	1.431g/cm3
Boiling Point	450.2ºC at 760 mmHg
Molecular Formula	C₁₂H₁₆BrNO₄
Molecular Weight	318.16400
Flash Point	226.1ºC
Exact Mass	317.02600
PSA	68.39000
LogP	2.57140
Index of Refraction	1.551
InChIKey	YFNAQTXYIOAWOW-UHFFFAOYSA-N
SMILES	CCOC(=O)c1[nH]c(CBr)c(C(=O)OCC)c1C

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

HS Code	2933990090

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

2,4-Dimethyl-3,...

CAS#:2436-79-5

~41%

5-BROMOMETHYL-3...

CAS#:57745-26-3

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Literature: Byun; Lightner Journal of Heterocyclic Chemistry, 1991 , vol. 28, # 7 p. 1683 - 1692

Ethyl acetoacetate

CAS#:141-97-9

5-BROMOMETHYL-3...

CAS#:57745-26-3

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Literature: Byun; Lightner Journal of Heterocyclic Chemistry, 1991 , vol. 28, # 7 p. 1683 - 1692

2,4-Dimethyl-3,...

CAS#:2436-79-5

5-BROMOMETHYL-3...

CAS#:57745-26-3

5-dibromomethyl...

CAS#:100388-27-0

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Literature: Treibs; Bader Justus Liebigs Annalen der Chemie, 1959 , vol. 627, p. 182,192

2,4-Dimethyl-3,...

CAS#:2436-79-5

Bromine

CAS#:7726-95-6

acetic acid

CAS#:64-19-7

5-BROMOMETHYL-3...

CAS#:57745-26-3

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Literature: Fischer; Schormueller Justus Liebigs Annalen der Chemie, 1929 , vol. 473, p. 211,234 Full Text Show Details Fischer; Halbig Justus Liebigs Annalen der Chemie, 1926 , vol. 447, p. 126,137 Justus Liebigs Annalen der Chemie, 1926 , vol. 448, p. 199

5-methoxymethyl...

CAS#:100450-66-6

Hydrogen bromide

CAS#:10035-10-6

5-BROMOMETHYL-3...

CAS#:57745-26-3

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Literature: Fischer; Scheyer Justus Liebigs Annalen der Chemie, 1923 , vol. 434, p. 251

1H-Pyrrole-2,4-...

CAS#:5422-89-9

Hydrogen bromide

CAS#:10035-10-6

acetic acid

CAS#:64-19-7

5-BROMOMETHYL-3...

CAS#:57745-26-3

Learn More

Literature: Fischer; Ernst Justus Liebigs Annalen der Chemie, 1926 , vol. 447, p. 158

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor 7
CAS#:2436-79-5 2,4-Dimethyl-3,... CAS#:141-97-9 Ethyl acetoacetate CAS#:7726-95-6 Bromine CAS#:64-19-7 acetic acid
CAS#:100450-66-6 5-methoxymethyl... CAS#:10035-10-6 Hydrogen bromide CAS#:5422-89-9 1H-Pyrrole-2,4-...
DownStream 9
CAS#:28420-86-2 1H-Pyrrole-3-ca... CAS#:2436-79-5 2,4-Dimethyl-3,... CAS#:5431-96-9 1H-Pyrrole-2,4-... CAS#:83633-42-5 diethyl 3-methy...
CAS#:2199-60-2 1H-Pyrrole-2,4-... CAS#:911-70-6 diethyl 5-[(4-e... CAS#:6266-25-7 1H-Pyrrole-2,4-... CAS#:6305-92-6 1H-Pyrrole-2,4-...
CAS#:100450-66-6 5-methoxymethyl...

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262

Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979

Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN

Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN

Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750

Total 6, Current Page 1 of 1

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

2-Bromomethyl-4-methyl-3,5-dicarboethoxy-1H-pyrrole

5-bromomethyl-3-methyl-pyrrole-2,4-dicarboxylic acid diethyl ester

5-Brommethyl-3-methyl-pyrrol-2,4-dicarbonsaeure-diaethylester

4-Methyl-2-brommethyl-3,5-diethoxycarbonyl-pyrrol

5-Bromomethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the polar surface area (PSA) of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: Polar surface area (PSA) of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is 68.39000.

Q: What is the SMILES notation of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: SMILES notation of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is CCOC(=O)c1[nH]c(CBr)c(C(=O)OCC)c1C.

Q: What is the boiling point of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: Boiling point of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is 450.2ºC at 760 mmHg.

Q: What are the upstream materials of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: Related upstream materials(CAS) of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate: 2436-79-5;141-97-9;7726-95-6;64-19-7;100450-66-6;10035-10-6;5422-89-9.

Q: What is the molecular weight of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: Molecular weight of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is 318.16400.

Q: What English synonyms does diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate have?

A: English synonyms of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate: 2-Bromomethyl-4-methyl-3,5-dicarboethoxy-1H-pyrrole, 5-bromomethyl-3-methyl-pyrrole-2,4-dicarboxylic acid diethyl ester, 5-Brommethyl-3-methyl-pyrrol-2,4-dicarbonsaeure-diaethylester, 4-Methyl-2-brommethyl-3,5-diethoxycarbonyl-pyrrol, 5-Bromomethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester.

Q: What is the English name of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: The English name of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate.

Q: What is the CAS number of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: CAS number of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is 57745-26-3.

Q: What is the LogP of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: LogP of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate is 2.57140.

Q: What are the downstream products of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate?

A: Related downstream products(CAS) of diethyl 5-(bromomethyl)-3-methyl-1H-pyrrole-2,4-dicarboxylate: 28420-86-2;2436-79-5;5431-96-9;83633-42-5;2199-60-2;911-70-6;6266-25-7;6305-92-6;100450-66-6.

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Dayang Chem (Hangzhou) Co., Ltd.

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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 5-BROMOMETHYL-3-METHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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5-BROMOMETHYL-3-METHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER

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The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.