Chemical Properties of 1H-Pyrrole-2-carboxylic acid, 4,5-dimethyl-, ethyl ester (CAS 2199-45-3)

1H-Pyrrole-2-carboxylic acid, 4,5-dimethyl-, ethyl ester

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InChI
InChI=1S/C9H13NO2/c1-4-12-9(11)8-5-6(2)7(3)10-8/h5,10H,4H2,1-3H3
InChI Key
NJUXFNQDUIJYPO-UHFFFAOYSA-N
Formula
C9H13NO2
SMILES
CCOC(=O)c1cc(C)c(C)[nH]1
Molecular Weight1
167.21
CAS
2199-45-3
Other Names
  • 4,5-Dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester
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Physical Properties

Property Value Unit Source
ΔcH°solid -4950.10 ± 5.00 kJ/mol NIST
ΔfH°solid -449.40 ± 5.00 kJ/mol NIST
log10WS -2.30 Crippen Calculated Property
logPoct/wat 1.326 Crippen Calculated Property
McVol 135.630 ml/mol McGowan Calculated Property

Similar Compounds

1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester. 1H-Pyrrole-2-carboxylic acid, 3,4,5-trimethyl, ethyl ester. 3,5-Dimethyl-4-propyl-1H-pyrrole-2-carboxylic acid ethyl ester. 2,4-Dimethyl-1H-pyrrole-5-carboxylic acid methyl ester. 1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester. Dimetindene M (nor, OH), acetylated. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. narwedine. Beclomethasone, tetra-TMS. Lycoramine. Dimetindene M (nor), acetylated. RTI 23. Mandelic acid, «alpha»-cyclopentyl-, 1-methyl-4-piperidyl ester. 1,3,5(10)-Oestratriene-2-methoxy-3,16«alpha»,17«beta»-triol, 3-TBDMS-16,17-PFP.

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