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98197-72-9 | 4-Iodo-2-methoxypyridine
CAS No: 98197-72-9 Catalog No: AG00342R MDL No:MFCD08277272
Product Description
Catalog Number:
AG00342R
Chemical Name:
4-Iodo-2-methoxypyridine
CAS Number:
98197-72-9
Molecular Formula:
C6H6INO
Molecular Weight:
235.0224
MDL Number:
MFCD08277272
IUPAC Name:
4-iodo-2-methoxypyridine
InChI:
InChI=1S/C6H6INO/c1-9-6-4-5(7)2-3-8-6/h2-4H,1H3
InChI Key:
JWIBTPMTSDSVQR-UHFFFAOYSA-N
SMILES:
COc1cc(I)ccn1
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:
1.8
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