Home Nitriles 3-Hydroxy-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4'-carbonitrile, 98+% C11H13N3O, MW

3-Hydroxy-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4'-carbonitrile, 98+% C11H13N3O, MW

CAS No.:
939986-85-3
Catalog Number:
AG00H1G6
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
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Product Description
Catalog Number:
AG00H1G6
Chemical Name:
3-Hydroxy-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4'-carbonitrile, 98+% C11H13N3O, MW
CAS Number:
939986-85-3
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD09607852
IUPAC Name:
2-(3-hydroxypiperidin-1-yl)pyridine-4-carbonitrile
InChI:
InChI=1S/C11H13N3O/c12-7-9-3-4-13-11(6-9)14-5-1-2-10(15)8-14/h3-4,6,10,15H,1-2,5,8H2
InChI Key:
LUYRULBZAMSEFC-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1)N1CCCC(C1)O
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties