1-Pyrrolidinecarboxylic acid, 2-cyano-, phenylmethyl ester


Chemical Name: 1-Pyrrolidinecarboxylic acid, 2-cyano-, phenylmethyl ester
CAS Number: 119020-06-3
Product Number: AG000P2R(AGN-PC-002N08)
Synonyms:
MDL No: MFCD04115334
Molecular Formula: C13H14N2O2
Molecular Weight: 230.2625

Identification/Properties


Properties
BP:
403.6±45.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
230.267g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
230.106g/mol
Monoisotopic Mass:
230.106g/mol
Topological Polar Surface Area:
53.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
315
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


NMR Spectrum


Other Analytical Data


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