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149554-03-0 | 1-Piperidineacetic acid, 4-oxo-, 1,1-dimethylethyl ester
CAS No: 149554-03-0 Catalog No: AG001LTL MDL No:MFCD07371646
Product Description
Catalog Number:
AG001LTL
Chemical Name:
1-Piperidineacetic acid, 4-oxo-, 1,1-dimethylethyl ester
CAS Number:
149554-03-0
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
MDL Number:
MFCD07371646
IUPAC Name:
tert-butyl 2-(4-oxopiperidin-1-yl)acetate
InChI:
InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)8-12-6-4-9(13)5-7-12/h4-8H2,1-3H3
InChI Key:
SBVOSDPEDKERMR-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CN1CCC(=O)CC1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.277g/mol
Monoisotopic Mass:
213.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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