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Home >> Chemical Listing >> Page 2611 >> 4-Isobutyryl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

4-Isobutyryl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
[CAS# 793727-85-2]

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Identification
Name 4-Isobutyryl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
Synonyms 1H-PYRROLE-2-CARBOXYLICACID, 3,5-DIMETHYL-4-(2-METHYL-1-OXOPROPYL)-; 4-isobutyryl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
Molecular Structure CAS#: 793727-85-2, 4-Isobutyryl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
Molecular Formula C11H15NO3
Molecular Weight 209.24
CAS Registry Number 793727-85-2
SMILES O=C(O)c1c(c(C(=O)C(C)C)c(n1)C)C
InChI 1S/C11H15NO3/c1-5(2)10(13)8-6(3)9(11(14)15)12-7(8)4/h5,12H,1-4H3,(H,14,15)
InChIKey IRXBKLCZUFUTBK-UHFFFAOYSA-N
Properties
Density 1.177g/cm3 (Cal.)
Boiling point 402.419°C at 760 mmHg (Cal.)
Flash point 197.176°C (Cal.)
Refractive index 1.549 (Cal.)
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