Home Nitriles 4-[(4-methylpiperidin-1-yl)methyl]benzonitrile

4-[(4-methylpiperidin-1-yl)methyl]benzonitrile

CAS No.:
1000931-95-2
Catalog Number:
AG019L7Z
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
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Product Description
Catalog Number:
AG019L7Z
Chemical Name:
4-[(4-methylpiperidin-1-yl)methyl]benzonitrile
CAS Number:
1000931-95-2
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
MDL Number:
MFCD09863331
IUPAC Name:
4-[(4-methylpiperidin-1-yl)methyl]benzonitrile
InChI:
InChI=1S/C14H18N2/c1-12-6-8-16(9-7-12)11-14-4-2-13(10-15)3-5-14/h2-5,12H,6-9,11H2,1H3
InChI Key:
CSHDBZOBKRBPGW-UHFFFAOYSA-N
SMILES:
CC1CCN(CC1)Cc1ccc(cc1)C#N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.147g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.312g/mol
Monoisotopic Mass:
214.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties