3-Pyrrolidineacetic acid,2-carboxy-4-[(1Z,3E,5R)-5-carboxy-1-methyl-1,3-hexadienyl]-,(2S,3S,4S)-


Chemical Name: 3-Pyrrolidineacetic acid,2-carboxy-4-[(1Z,3E,5R)-5-carboxy-1-methyl-1,3-hexadienyl]-,(2S,3S,4S)-
CAS Number: 14277-97-5
Product Number: AG007Z9T(AGN-PC-0PSXKU)
Synonyms:
MDL No:
Molecular Formula: C15H21NO6
Molecular Weight: 311.3303

Identification/Properties


Computed Properties
Molecular Weight:
311.334g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
311.137g/mol
Monoisotopic Mass:
311.137g/mol
Topological Polar Surface Area:
124A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
510
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
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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