Home Carboxys tert-Butyl 3-oxo-4-phenylpiperidine-1-carboxylate

tert-Butyl 3-oxo-4-phenylpiperidine-1-carboxylate

CAS No.:
930396-00-2
Catalog Number:
AG00IHGN
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
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Product Description
Catalog Number:
AG00IHGN
Chemical Name:
tert-Butyl 3-oxo-4-phenylpiperidine-1-carboxylate
CAS Number:
930396-00-2
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
IUPAC Name:
tert-butyl 3-oxo-4-phenylpiperidine-1-carboxylate
InChI:
InChI=1S/C16H21NO3/c1-16(2,3)20-15(19)17-10-9-13(14(18)11-17)12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3
InChI Key:
MBZIXYGSCLOCQG-UHFFFAOYSA-N
SMILES:
O=C1CN(CCC1c1ccccc1)C(=O)OC(C)(C)C
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.152g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.348g/mol
Monoisotopic Mass:
275.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties