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1008510-46-0 | 1-Piperidinecarboxylic acid, 2-methyl-4,6-dioxo-, 1,1-dimethylethyl ester
CAS No: 1008510-46-0 Catalog No: AG00030D MDL No:
Product Description
Catalog Number:
AG00030D
Chemical Name:
1-Piperidinecarboxylic acid, 2-methyl-4,6-dioxo-, 1,1-dimethylethyl ester
CAS Number:
1008510-46-0
Molecular Formula:
C11H17NO4
Molecular Weight:
227.2570
IUPAC Name:
tert-butyl 2-methyl-4,6-dioxopiperidine-1-carboxylate
InChI:
InChI=1S/C11H17NO4/c1-7-5-8(13)6-9(14)12(7)10(15)16-11(2,3)4/h7H,5-6H2,1-4H3
InChI Key:
UAPGGOOREDFMCD-UHFFFAOYSA-N
SMILES:
O=C1CC(C)N(C(=O)C1)C(=O)OC(C)(C)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.26g/mol
Monoisotopic Mass:
227.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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