Home Other Building Blocks butyl 2-(4-cyanopiperidin-1-yl)acetate

butyl 2-(4-cyanopiperidin-1-yl)acetate

CAS No.:
1457358-72-3
Catalog Number:
AG01A68B
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
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Product Description
Catalog Number:
AG01A68B
Chemical Name:
butyl 2-(4-cyanopiperidin-1-yl)acetate
CAS Number:
1457358-72-3
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
MDL Number:
MFCD20047817
IUPAC Name:
butyl 2-(4-cyanopiperidin-1-yl)acetate
InChI:
InChI=1S/C12H20N2O2/c1-2-3-8-16-12(15)10-14-6-4-11(9-13)5-7-14/h11H,2-8,10H2,1H3
InChI Key:
YCRSJYPMBDRMTL-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)CN1CCC(CC1)C#N
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.304g/mol
Monoisotopic Mass:
224.152g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties