Home Carboxys Methyl 1-benzyl-3-oxopiperidine-4-carboxylate

Methyl 1-benzyl-3-oxopiperidine-4-carboxylate

CAS No.:
175406-94-7
Catalog Number:
AG0020Y7
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
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Product Description
Catalog Number:
AG0020Y7
Chemical Name:
Methyl 1-benzyl-3-oxopiperidine-4-carboxylate
CAS Number:
175406-94-7
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
MDL Number:
MFCD00012792
IUPAC Name:
methyl 1-benzyl-3-oxopiperidine-4-carboxylate
InChI:
InChI=1S/C14H17NO3/c1-18-14(17)12-7-8-15(10-13(12)16)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChI Key:
ZBQNYNWPYXTUTB-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCN(CC1=O)Cc1ccccc1
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties