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1272758-17-4 | 2-Azaspiro[4.5]decane-2-carboxylic acid, 8-oxo-, 1,1-dimethylethyl ester
CAS No: 1272758-17-4 Catalog No: AG000WVJ MDL No:MFCD18711592
Product Description
Catalog Number:
AG000WVJ
Chemical Name:
2-Azaspiro[4.5]decane-2-carboxylic acid, 8-oxo-, 1,1-dimethylethyl ester
CAS Number:
1272758-17-4
Molecular Formula:
C14H23NO3
Molecular Weight:
253.3373
MDL Number:
MFCD18711592
IUPAC Name:
tert-butyl 8-oxo-2-azaspiro[4.5]decane-2-carboxylate
InChI:
InChI=1S/C14H23NO3/c1-13(2,3)18-12(17)15-9-8-14(10-15)6-4-11(16)5-7-14/h4-10H2,1-3H3
InChI Key:
CHSKMGWWUHJSMO-UHFFFAOYSA-N
SMILES:
O=C1CCC2(CC1)CCN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.168g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.342g/mol
Monoisotopic Mass:
253.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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