Home Carboxys tert-butyl 3-azabicyclo[4.1.0]heptane-3-carboxylate

tert-butyl 3-azabicyclo[4.1.0]heptane-3-carboxylate

CAS No.:
1822599-92-7
Catalog Number:
AG01B3X0
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
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Product Description
Catalog Number:
AG01B3X0
Chemical Name:
tert-butyl 3-azabicyclo[4.1.0]heptane-3-carboxylate
CAS Number:
1822599-92-7
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
MDL Number:
MFCD24505212
IUPAC Name:
tert-butyl 3-azabicyclo[4.1.0]heptane-3-carboxylate
InChI:
InChI=1S/C11H19NO2/c1-11(2,3)14-10(13)12-5-4-8-6-9(8)7-12/h8-9H,4-7H2,1-3H3
InChI Key:
FOPVHPXCOOUMKS-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2C(C1)C2)OC(C)(C)C
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties