Home Nitriles 2-(3,5-dimethylpiperidin-1-yl)acetonitrile

2-(3,5-dimethylpiperidin-1-yl)acetonitrile

CAS No.:
951905-18-3
Catalog Number:
AG01A9RM
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
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Product Description
Catalog Number:
AG01A9RM
Chemical Name:
2-(3,5-dimethylpiperidin-1-yl)acetonitrile
CAS Number:
951905-18-3
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
MDL Number:
MFCD09906894
IUPAC Name:
2-(3,5-dimethylpiperidin-1-yl)acetonitrile
InChI:
InChI=1S/C9H16N2/c1-8-5-9(2)7-11(6-8)4-3-10/h8-9H,4-7H2,1-2H3
InChI Key:
KEHLLCJFZXAPCW-UHFFFAOYSA-N
SMILES:
CC1CC(C)CN(C1)CC#N
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.131g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.241g/mol
Monoisotopic Mass:
152.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties