Home Carboxys tert-butyl 4-oxo-1-oxa-9-azaspiro[5.5]undec-2-ene-9-carboxylate

tert-butyl 4-oxo-1-oxa-9-azaspiro[5.5]undec-2-ene-9-carboxylate

CAS No.:
1346229-50-2
Catalog Number:
AG01BICM
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
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Product Description
Catalog Number:
AG01BICM
Chemical Name:
tert-butyl 4-oxo-1-oxa-9-azaspiro[5.5]undec-2-ene-9-carboxylate
CAS Number:
1346229-50-2
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
MDL Number:
MFCD24471469
IUPAC Name:
tert-butyl 4-oxo-1-oxa-9-azaspiro[5.5]undec-2-ene-9-carboxylate
InChI:
InChI=1S/C14H21NO4/c1-13(2,3)19-12(17)15-7-5-14(6-8-15)10-11(16)4-9-18-14/h4,9H,5-8,10H2,1-3H3
InChI Key:
NGVQWGUTUXGNJC-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)OC=CC(=O)C2)OC(C)(C)C
Properties
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.147g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.325g/mol
Monoisotopic Mass:
267.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties