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1198284-49-9 | 3-Azaspiro[5.5]undecane-3-carboxylic acid, 7-oxo-, 1,1-dimethylethyl ester
CAS No: 1198284-49-9 Catalog No: AG000PQN MDL No:MFCD11616070
Product Description
Catalog Number:
AG000PQN
Chemical Name:
3-Azaspiro[5.5]undecane-3-carboxylic acid, 7-oxo-, 1,1-dimethylethyl ester
CAS Number:
1198284-49-9
Molecular Formula:
C15H25NO3
Molecular Weight:
267.3639
MDL Number:
MFCD11616070
IUPAC Name:
tert-butyl 11-oxo-3-azaspiro[5.5]undecane-3-carboxylate
InChI:
InChI=1S/C15H25NO3/c1-14(2,3)19-13(18)16-10-8-15(9-11-16)7-5-4-6-12(15)17/h4-11H2,1-3H3
InChI Key:
WPVRVDKDXFXDFM-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(CC1)CCCCC2=O)OC(C)(C)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.183g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.369g/mol
Monoisotopic Mass:
267.183g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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