1H-Pyrrole-2-carboxylicacid,4-formyl-3,5-dimethyl-,ethyl ester

CAS

2199-64-6

Catalog Number

ACM2199646

Category

Other Products

Molecular Weight

195.22

Molecular Formula

C₁₀H₁₃NO₃

MSDS COA Spec Sheet

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Specification

Synonyms

TIMTEC-BB SBB010134;ETHYL 4-FORMYL-3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLATE;BUTTPARK 96\50-08;4-FORMYL-3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER;1H-Pyrrole-2-carboxylic acid, 4-formyl-3,5-dimethyl-, ethyl ester;Ethyl 3,5-dimethyl-4-formylpyrrole

IUPAC Name

ethyl 4-formyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Canonical SMILES

CCOC(=O)C1=C(C(=C(N1)C)C=O)C

InChI Key

CLJUICOFPKFFGJ-UHFFFAOYSA-N

Boiling Point

347.8ºC at 760mmHg

Melting Point

144ºC

Flash Point

164.1ºC

Density

1.173g/cm³

Exact Mass

195.09000

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

S26-S37/39

Downstream Synthesis Route 1

2199-64-6

938-75-0

Reference: [1] Justus Liebigs Annalen der Chemie, 1938, vol. 533, p. 216,229

Downstream Synthesis Route 2

2199-64-6

17120-26-2

Reference: [1]Current Patent Assignee: OTSUKA HOLDINGS CO LTD - EP1911755, 2008, A1
Location in patent: Page/Page column 30-31
[2]Fischer; Weiss; Schubert
[Chemische Berichte, 1923, vol. 56, p. 1198]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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