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219635-89-9 | 1-(5-Iodopyridin-2-yl)piperazine
CAS No: 219635-89-9 Catalog No: AG003D1L MDL No:MFCD04039867
Product Description
Catalog Number:
AG003D1L
Chemical Name:
1-(5-Iodopyridin-2-yl)piperazine
CAS Number:
219635-89-9
Molecular Formula:
C9H12IN3
Molecular Weight:
289.1161
MDL Number:
MFCD04039867
IUPAC Name:
1-(5-iodopyridin-2-yl)piperazine
InChI:
InChI=1S/C9H12IN3/c10-8-1-2-9(12-7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2
InChI Key:
MKKJIJFTSAYHBW-UHFFFAOYSA-N
SMILES:
Ic1ccc(nc1)N1CCNCC1
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.008g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.12g/mol
Monoisotopic Mass:
289.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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