(3S)-3-amino-1-benzylpyrrolidine-3-carboxylic acid


Chemical Name: (3S)-3-amino-1-benzylpyrrolidine-3-carboxylic acid
CAS Number: 145602-87-5
Product Number: AG001D8F(AGN-PC-00OCQT)
Synonyms:
MDL No: MFCD06410530
Molecular Formula: C12H16N2O2
Molecular Weight: 220.2676

Identification/Properties


Properties
BP:
371.22°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
220.272g/mol
XLogP3:
-1.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
220.121g/mol
Monoisotopic Mass:
220.121g/mol
Topological Polar Surface Area:
66.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
264
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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