Home Carboxys 3-(2-Oxiranyl)-1-piperidinecarboxylic acid 1,1-dimethylethylester

3-(2-Oxiranyl)-1-piperidinecarboxylic acid 1,1-dimethylethylester

CAS No.:
405087-74-3
Catalog Number:
AG00CB3E
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
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Product Description
Catalog Number:
AG00CB3E
Chemical Name:
3-(2-Oxiranyl)-1-piperidinecarboxylic acid 1,1-dimethylethylester
CAS Number:
405087-74-3
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD11656421
IUPAC Name:
tert-butyl 3-(oxiran-2-yl)piperidine-1-carboxylate
InChI:
InChI=1S/C12H21NO3/c1-12(2,3)16-11(14)13-6-4-5-9(7-13)10-8-15-10/h9-10H,4-8H2,1-3H3
InChI Key:
YIKGDITZMFUCDL-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(C1)C1CO1)OC(C)(C)C
Properties
Complexity:
272  
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:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties