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1331850-50-0 | Pyridine, 4-iodo-3-methoxy-
CAS No: 1331850-50-0 Catalog No: AG0014DV MDL No:
Product Description
Catalog Number:
AG0014DV
Chemical Name:
Pyridine, 4-iodo-3-methoxy-
CAS Number:
1331850-50-0
Molecular Formula:
C6H6INO
Molecular Weight:
235.0224
IUPAC Name:
4-iodo-3-methoxypyridine
InChI:
InChI=1S/C6H6INO/c1-9-6-4-8-3-2-5(6)7/h2-4H,1H3
InChI Key:
FRLJNIIXFJXKOC-UHFFFAOYSA-N
SMILES:
COc1cnccc1I
Properties
Complexity:
89.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.949g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.024g/mol
Monoisotopic Mass:
234.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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