1H-Pyrrole-2-acetic acid, 1-methyl-, methyl ester


Chemical Name: 1H-Pyrrole-2-acetic acid, 1-methyl-, methyl ester
CAS Number: 51856-79-2
Product Number: AG0032TD(AGN-PC-0JLE2C)
Synonyms:
MDL No:
Molecular Formula: C8H11NO2
Molecular Weight: 153.1784

Identification/Properties


Properties
MP:
≥210 °C
BP:
242°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.501(lit.)
Solubility:
8.3 g/L (20°C)
Computed Properties
Molecular Weight:
153.181g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
153.079g/mol
Monoisotopic Mass:
153.079g/mol
Topological Polar Surface Area:
31.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
147
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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