tert-butyl 3-hydroxy-3-(trifluoromethyl)pyrrolidine-1-carboxylate


Chemical Name: tert-butyl 3-hydroxy-3-(trifluoromethyl)pyrrolidine-1-carboxylate
CAS Number: 644970-36-5
Product Number: AG00ELAH(AGN-PC-08XRCI)
Synonyms:
MDL No:
Molecular Formula: C10H16F3NO3
Molecular Weight: 255.2341

Identification/Properties


Computed Properties
Molecular Weight:
255.237g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
255.108g/mol
Monoisotopic Mass:
255.108g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
311
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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