Home Carboxys tert-butyl 6-(trifluoromethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate

tert-butyl 6-(trifluoromethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate

CAS No.:
1935266-44-6
Catalog Number:
AG01EIP8
Molecular Formula:
C11H16F3NO2
Molecular Weight:
251.2454
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Product Description
Catalog Number:
AG01EIP8
Chemical Name:
tert-butyl 6-(trifluoromethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
CAS Number:
1935266-44-6
Molecular Formula:
C11H16F3NO2
Molecular Weight:
251.2454
MDL Number:
MFCD30206486
IUPAC Name:
tert-butyl 6-(trifluoromethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
InChI:
InChI=1S/C11H16F3NO2/c1-10(2,3)17-9(16)15-5-4-6-7(8(6)15)11(12,13)14/h6-8H,4-5H2,1-3H3
InChI Key:
UZKCQCJKIGOIRS-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2C1C2C(F)(F)F)OC(C)(C)C
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.113g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.249g/mol
Monoisotopic Mass:
251.113g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties