Home Carboxys tert-butyl 3-oxa-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate

tert-butyl 3-oxa-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate

CAS No.:
1250996-94-1
Catalog Number:
AG01DJQ1
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
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Product Description
Catalog Number:
AG01DJQ1
Chemical Name:
tert-butyl 3-oxa-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate
CAS Number:
1250996-94-1
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
MDL Number:
MFCD17017631
IUPAC Name:
tert-butyl 3-oxa-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate
InChI:
InChI=1S/C11H17NO3/c1-11(2,3)15-10(13)12-8-4-5-9(12)7-14-6-8/h4-5,8-9H,6-7H2,1-3H3
InChI Key:
KTJGIZVGQFSDEO-UHFFFAOYSA-N
SMILES:
O=C(N1C2COCC1C=C2)OC(C)(C)C
Properties
Complexity:
279  
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  
Properties