Home Carboxys 1-Piperidinecarboxylic acid, 3,5-diMethyl-4-oxo-, 1,1-diMethylethylester

1-Piperidinecarboxylic acid, 3,5-diMethyl-4-oxo-, 1,1-diMethylethylester

CAS No.:
475085-34-8
Catalog Number:
AG00DLNV
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
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Product Description
Catalog Number:
AG00DLNV
Chemical Name:
1-Piperidinecarboxylic acid, 3,5-diMethyl-4-oxo-, 1,1-diMethylethylester
CAS Number:
475085-34-8
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD14635714
IUPAC Name:
tert-butyl 3,5-dimethyl-4-oxopiperidine-1-carboxylate
InChI:
InChI=1S/C12H21NO3/c1-8-6-13(7-9(2)10(8)14)11(15)16-12(3,4)5/h8-9H,6-7H2,1-5H3
InChI Key:
WTHLCGOZBTXTTE-UHFFFAOYSA-N
SMILES:
CC1CN(CC(C1=O)C)C(=O)OC(C)(C)C
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.304g/mol
Monoisotopic Mass:
227.152g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties