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Home > Bromides > 1289110-84-4
1289110-84-4 | 4-Piperidinecarbonitrile, 1-(5-bromo-3-pyridinyl)-
CAS No: 1289110-84-4 Catalog No: AG000YIJ MDL No:
Product Description
Catalog Number:
AG000YIJ
Chemical Name:
4-Piperidinecarbonitrile, 1-(5-bromo-3-pyridinyl)-
CAS Number:
1289110-84-4
Molecular Formula:
C11H12BrN3
Molecular Weight:
266.1371
IUPAC Name:
1-(5-bromopyridin-3-yl)piperidine-4-carbonitrile
InChI:
InChI=1S/C11H12BrN3/c12-10-5-11(8-14-7-10)15-3-1-9(6-13)2-4-15/h5,7-9H,1-4H2
InChI Key:
ZTJOIJLNFRGLHP-UHFFFAOYSA-N
SMILES:
N#CC1CCN(CC1)c1cncc(c1)Br
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.021g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.142g/mol
Monoisotopic Mass:
265.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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