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87539-52-4 | Benzene, 1-iodosyl-4-methoxy-
CAS No: 87539-52-4 Catalog No: AG004DDZ MDL No:
Product Description
Catalog Number:
AG004DDZ
Chemical Name:
Benzene, 1-iodosyl-4-methoxy-
CAS Number:
87539-52-4
Molecular Formula:
C7H7IO2
Molecular Weight:
250.0338
IUPAC Name:
1-iodosyl-4-methoxybenzene
InChI:
InChI=1S/C7H7IO2/c1-10-7-4-2-6(8-9)3-5-7/h2-5H,1H3
InChI Key:
DUKIEEHLZZTBGX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)[I]=O
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.949g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.035g/mol
Monoisotopic Mass:
249.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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