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[3-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-pyrrol-2-yl)phenyl]acetic acid
[CAS# 672309-90-9]

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Identification
Name [3-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-pyrrol-2-yl)phenyl]acetic acid
Synonyms 2-(3-Carboxymethyl-phenyl)-pyrrole-1-carboxylic acid tert-butyl ester; 3-(2'-N-Boc-Pyrrole)phenylacetic acid
Molecular Structure CAS#: 672309-90-9, [3-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1H-pyrrol-2-yl)phenyl]acetic acid
Molecular Formula C17H19NO4
Molecular Weight 301.34
CAS Registry Number 672309-90-9
SMILES O=C(O)Cc2cccc(c1cccn1C(=O)OC(C)(C)C)c2
InChI 1S/C17H19NO4/c1-17(2,3)22-16(21)18-9-5-8-14(18)13-7-4-6-12(10-13)11-15(19)20/h4-10H,11H2,1-3H3,(H,19,20)
InChIKey ZGDYXPZYMVDNCX-UHFFFAOYSA-N
Properties
Density 1.154g/cm3 (Cal.)
Boiling point 466.058°C at 760 mmHg (Cal.)
Flash point 235.664°C (Cal.)
Refractive index 1.554 (Cal.)
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