tert-butyl 3-cyano-3-hydroxypyrrolidine-1-carboxylate


Chemical Name: tert-butyl 3-cyano-3-hydroxypyrrolidine-1-carboxylate
CAS Number: 1194376-31-2
Product Number: AG000IRV(AGN-PC-07CT01)
Synonyms:
MDL No:
Molecular Formula: C10H16N2O3
Molecular Weight: 212.2456

Identification/Properties


Computed Properties
Molecular Weight:
212.249g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
212.116g/mol
Monoisotopic Mass:
212.116g/mol
Topological Polar Surface Area:
73.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
312
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

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NMR Spectrum


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