Home Nitriles 3-(piperidin-1-yl)butanenitrile

3-(piperidin-1-yl)butanenitrile

CAS No.:
32813-37-9
Catalog Number:
AG01A656
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
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Product Description
Catalog Number:
AG01A656
Chemical Name:
3-(piperidin-1-yl)butanenitrile
CAS Number:
32813-37-9
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
MDL Number:
MFCD13183999
IUPAC Name:
3-piperidin-1-ylbutanenitrile
InChI:
InChI=1S/C9H16N2/c1-9(5-6-10)11-7-3-2-4-8-11/h9H,2-5,7-8H2,1H3
InChI Key:
ARZHGISVFNEUQS-UHFFFAOYSA-N
SMILES:
CC(N1CCCCC1)CC#N
Properties
Complexity:
150  
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:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties