ChemicalBook--->CAS DataBase List--->2436-79-5

2436-79-5

2436-79-5 Structure

2436-79-5 Structure
IdentificationMore
[Name]

Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate
[CAS]

2436-79-5
[Synonyms]

3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID DIETHYL ESTER
DIETHYL 2,4-DIMETHYL-1H-PYRROLE-3,5-DICARBOXYLATE
DIETHYL 2,4-DIMETHYLPYRROLE-3,5-DICARBOXYLATE
DIETHYL 3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLATE
DIETHYL 3,5-DIMETHYL 2,4-DICARBOXYLATE PYRROLE
RARECHEM AL BI 0939
TIMTEC-BB SBB003220
1H-Pyrrole-2,4-dicarboxylicacid,3,5-dimethyl-,diethylester
2,4-Dimethyl-3,5-dicarbethoxypyrrole
2,4-Dimethyl-3,5-diethoxycarbonyl-pyrrole
Diethyl 3,5-dimethylpyrrole-2,4-dicarboxylate
Knorr's pyrrole
Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester
Pyrrole-3,5-bis(carboxylic acid), 2,4-dimethyl-, diethyl ester
Diethyl 2,4-Dimethyl-Pyrrol-3,5-Dicarboxylate
Diethyl 2,4-Dimethylpyrrole-3,5-Dicarbonate
2,4-dimethylpyrrole-3,5-dicarboxylic acid diethyl ester
Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate 98%
diethyl-3,5-dimethyl-1 pyrrole-2,4-dlcarboxylate
Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate ,98%
[EINECS(EC#)]

219-431-2
[Molecular Formula]

C12H17NO4
[MDL Number]

MFCD00005218
[Molecular Weight]

239.27
[MOL File]

2436-79-5.mol
Chemical PropertiesBack Directory
[Appearance]

light yellow to light pink
[Melting point ]

135-136 °C(lit.)
[Boiling point ]

381.93°C (rough estimate)
[density ]

1.1724 (rough estimate)
[refractive index ]

1.5300 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

14.69±0.50(Predicted)
[color ]

Light yellow to Yellow to Orange
[Detection Methods]

HPLC,NMR
[InChI]

InChI=1S/C12H17NO4/c1-5-16-11(14)9-7(3)10(13-8(9)4)12(15)17-6-2/h13H,5-6H2,1-4H3
[InChIKey]

XSBSXJAYEPDGSF-UHFFFAOYSA-N
[SMILES]

N1C(C)=C(C(OCC)=O)C(C)=C1C(OCC)=O
[LogP]

3.850 (est)
[CAS DataBase Reference]

2436-79-5(CAS DataBase Reference)
[NIST Chemistry Reference]

1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester(2436-79-5)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

29339900
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,5-Dimethyl-1H-Pyrrole-2,4-dicarboxylic acid diethyl ester(2436-79-5).msds
Hazard InformationBack Directory
[Chemical Properties]

light yellow to light pink
[Uses]

Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate can be used in organic synthesis and experimental research.
[Synthesis]

Using Knorr pyrrole synthesis, diethyl 2,4-dimethyl-pyrrole-3,5-dicarboxylate was synthesized via one-pot method with ethyl acetoacetate and sodium nitrite as starting materials in the presence of acetic acid and zinc powder. 
Spectrum DetailBack Directory
[Spectrum Detail]

Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate(2436-79-5)1HNMR
Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate(2436-79-5)IR
Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate(2436-79-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate, 97%(2436-79-5)
[Alfa Aesar]

Diethyl 2,4-dimethylpyrrole-3,5-dicarboxylate, 97%(2436-79-5)
[Sigma Aldrich]

2436-79-5(sigmaaldrich)
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