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1227602-73-4 | Pyridine, 4-iodo-2-methoxy-5-methyl-
CAS No: 1227602-73-4 Catalog No: AG000JEX MDL No:
Product Description
Catalog Number:
AG000JEX
Chemical Name:
Pyridine, 4-iodo-2-methoxy-5-methyl-
CAS Number:
1227602-73-4
Molecular Formula:
C7H8INO
Molecular Weight:
249.0490
IUPAC Name:
4-iodo-2-methoxy-5-methylpyridine
InChI:
InChI=1S/C7H8INO/c1-5-4-9-7(10-2)3-6(5)8/h3-4H,1-2H3
InChI Key:
FCGALBYRWLDYAH-UHFFFAOYSA-N
SMILES:
COc1ncc(c(c1)I)C
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.965g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.051g/mol
Monoisotopic Mass:
248.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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