tert-butyl 4-amino-3-fluoroazepane-1-carboxylate, Mixture of diastereomers


Chemical Name: tert-butyl 4-amino-3-fluoroazepane-1-carboxylate, Mixture of diastereomers
CAS Number: 1823996-36-6
Product Number: AG01DTDV(AG01DTDV)
Synonyms:
MDL No:
Molecular Formula: C11H21FN2O2
Molecular Weight: 232.2950

Identification/Properties


Computed Properties
Molecular Weight:
232.299g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
232.159g/mol
Monoisotopic Mass:
232.159g/mol
Topological Polar Surface Area:
55.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
253
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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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