2-Pyrrolidinecarbonitrile, 1-(chloroacetyl)-, (2S)-


Chemical Name: 2-Pyrrolidinecarbonitrile, 1-(chloroacetyl)-, (2S)-
CAS Number: 207557-35-5
Product Number: AG002J4N(AGN-PC-0O7NPS)
Synonyms:
MDL No:
Molecular Formula: C7H9ClN2O
Molecular Weight: 172.6122

Identification/Properties


Properties
MP:
>60°C (dec.)
BP:
363.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
172.612g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
172.04g/mol
Monoisotopic Mass:
172.04g/mol
Topological Polar Surface Area:
44.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
208
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


NMR Spectrum


Other Analytical Data


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