Home Carboxys tert-Butyl 2-oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate

tert-Butyl 2-oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate

CAS No.:
110590-29-9
Catalog Number:
AG009U1Z
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$147
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Product Description
Catalog Number:
AG009U1Z
Chemical Name:
tert-Butyl 2-oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate
CAS Number:
110590-29-9
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
MDL Number:
MFCD24038975
IUPAC Name:
tert-butyl 2-oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate
InChI:
InChI=1S/C11H17NO3/c1-11(2,3)14-10(13)12-8-4-6-9(15-12)7-5-8/h4,6,8-9H,5,7H2,1-3H3
InChI Key:
KWICUYZLFNKYIA-UHFFFAOYSA-N
SMILES:
O=C(N1OC2CCC1C=C2)OC(C)(C)C
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties