tert-Butyl 4-cyano-2,2-dimethyl-3-oxopyrrolidine-1-carboxylate


Chemical Name: tert-Butyl 4-cyano-2,2-dimethyl-3-oxopyrrolidine-1-carboxylate
CAS Number: 946497-94-5
Product Number: AG00IIF1(AGN-PC-0WAMNJ)
Synonyms:
MDL No: MFCD08275049
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
238.287g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
238.132g/mol
Monoisotopic Mass:
238.132g/mol
Topological Polar Surface Area:
70.4A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
398
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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