1-Pyrrolidinecarboxylic acid, 3-(hydroxymethyl)-, phenylmethyl ester


Chemical Name: 1-Pyrrolidinecarboxylic acid, 3-(hydroxymethyl)-, phenylmethyl ester
CAS Number: 315718-05-9
Product Number: AG007IZ7(AGN-PC-01UH2J)
Synonyms:
MDL No:
Molecular Formula: C13H17NO3
Molecular Weight: 235.2790

Identification/Properties


Computed Properties
Molecular Weight:
235.283g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
235.121g/mol
Monoisotopic Mass:
235.121g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
251
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H317
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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