Chemical Properties of 2,4-Dimethyl-5-hydroxy-1H-pyrrol-3-carboxylic acid ethyl ester (CAS 4030-28-8)

2,4-Dimethyl-5-hydroxy-1H-pyrrol-3-carboxylic acid ethyl ester

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InChI
InChI=1S/C9H13NO3/c1-4-13-9(12)7-5(2)8(11)10-6(7)3/h10-11H,4H2,1-3H3
InChI Key
JNQZBAQUMFAVOI-UHFFFAOYSA-N
Formula
C9H13NO3
SMILES
CCOC(=O)c1c(C)[nH]c(O)c1C
Molecular Weight1
183.20
CAS
4030-28-8
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Physical Properties

Property Value Unit Source
ω 0.6942 Relay (... Calculated Property
ΔcH°solid -4714.90 ± 4.60 kJ/mol NIST
ΔfG° -269.72 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -556.06 kJ/mol Relay (... Calculated Property
ΔvapH° 89.72 kJ/mol Relay (... Calculated Property
IE 7.62 eV Relay (... Calculated Property
log10WS -1.96 Relay (... Calculated Property
logPoct/wat 1.032 Crippen Calculated Property
McVol 141.500 ml/mol McGowan Calculated Property
Pc 3991.16 kPa Relay (... Calculated Property ⚠️
Tboil 558.30 K Relay (... Calculated Property
Tc 789.54 K Relay (... Calculated Property
Tfus 455.55 K Relay (... Calculated Property
Vc 0.518 m3/kmol Relay (... Calculated Property

Similar Compounds

2,4,5-Trimethyl-1H-pyrrole-3-carboxylic acid ethyl ester. 1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, diethyl ester. Mandelic acid, «alpha»-cyclopentyl-, 1-methyl-4-piperidyl ester. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. Naloxone. 9H-Purin-2-amine, N-(trimethylsilyl)-6-[(trimethylsilyl)oxy]-9-[2,3,5-tris-O-(trimethylsilyl)-«beta»-D-ribofuranosyl]-. Cytidine, metho-oxime-TMS derivative. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Oxycodone. Cytidine, etho-oxime-TMS derivative. Cytidine, buto-oxime-TMS derivative. 2'-Deoxyguanosine, N-trimethylsilyl-, tris(trimethylsilyl) ether. guanosine, TMS. Epibaptifoline. Yohimbine.

Find more compounds similar to 2,4-Dimethyl-5-hydroxy-1H-pyrrol-3-carboxylic acid ethyl ester.

Sources

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