Home Nitriles 3-[(pyridin-2-ylmethyl)amino]propanenitrile

3-[(pyridin-2-ylmethyl)amino]propanenitrile

CAS No.:
112086-58-5
Catalog Number:
AG01AAOJ
Molecular Formula:
C9H11N3
Molecular Weight:
161.2037
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AAOJ
Chemical Name:
3-[(pyridin-2-ylmethyl)amino]propanenitrile
CAS Number:
112086-58-5
Molecular Formula:
C9H11N3
Molecular Weight:
161.2037
MDL Number:
MFCD11166782
IUPAC Name:
3-(pyridin-2-ylmethylamino)propanenitrile
InChI:
InChI=1S/C9H11N3/c10-5-3-6-11-8-9-4-1-2-7-12-9/h1-2,4,7,11H,3,6,8H2
InChI Key:
OJFRFZXFVWLMNA-UHFFFAOYSA-N
SMILES:
N#CCCNCc1ccccn1
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.208g/mol
Monoisotopic Mass:
161.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties