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Home > Fluorides > 1167056-58-7
1167056-58-7 | Benzene, 1-fluoro-3-iodo-5-methoxy-
CAS No: 1167056-58-7 Catalog No: AG000D40 MDL No:MFCD12405142
Product Description
Catalog Number:
AG000D40
Chemical Name:
Benzene, 1-fluoro-3-iodo-5-methoxy-
CAS Number:
1167056-58-7
Molecular Formula:
C7H6FIO
Molecular Weight:
252.0248
MDL Number:
MFCD12405142
IUPAC Name:
1-fluoro-3-iodo-5-methoxybenzene
InChI:
InChI=1S/C7H6FIO/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
InChI Key:
FLSYCEKFVMRKPY-UHFFFAOYSA-N
SMILES:
COc1cc(F)cc(c1)I
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.945g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.027g/mol
Monoisotopic Mass:
251.945g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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