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138761-37-2 | Pyridine, 4-(iodomethyl)-
CAS No: 138761-37-2 Catalog No: AG0019HL MDL No:
Product Description
Catalog Number:
AG0019HL
Chemical Name:
Pyridine, 4-(iodomethyl)-
CAS Number:
138761-37-2
Molecular Formula:
C6H6IN
Molecular Weight:
219.0230
IUPAC Name:
4-(iodomethyl)pyridine
InChI:
InChI=1S/C6H6IN/c7-5-6-1-3-8-4-2-6/h1-4H,5H2
InChI Key:
KQLHSXTTZXUVCW-UHFFFAOYSA-N
SMILES:
ICc1ccncc1
Properties
Complexity:
59.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.954g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.025g/mol
Monoisotopic Mass:
218.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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