3-(5-(METHOXYCARBONYL)-1H-PYRROL-2-YL)PROPANOIC ACID


Chemical Name: 3-(5-(METHOXYCARBONYL)-1H-PYRROL-2-YL)PROPANOIC ACID
CAS Number: 1041430-19-6
Product Number: AG01DTBA(AG01DTBA)
Synonyms:
MDL No:
Molecular Formula: C9H11NO4
Molecular Weight: 197.1879

Identification/Properties


Computed Properties
Molecular Weight:
197.19g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
197.069g/mol
Monoisotopic Mass:
197.069g/mol
Topological Polar Surface Area:
79.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
229
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


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