Glycine, N-(2-cyanophenyl)-, ethyl ester


Chemical Name: Glycine, N-(2-cyanophenyl)-, ethyl ester
CAS Number: 87223-76-5
Product Number: AG003Q1C(AGN-PC-0KKZRL)
Synonyms:
MDL No: MFCD00141059
Molecular Formula: C11H12N2O2
Molecular Weight: 204.2252

Identification/Properties


Properties
MP:
95-96°C
BP:
351.1°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
204.229g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
204.09g/mol
Monoisotopic Mass:
204.09g/mol
Topological Polar Surface Area:
62.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
257
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


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

NMR Spectrum


Other Analytical Data


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