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16825-76-6 | Benzene, 1-chloro-4-iodyl-
CAS No: 16825-76-6 Catalog No: AG001XXQ MDL No:
Product Description
Catalog Number:
AG001XXQ
Chemical Name:
Benzene, 1-chloro-4-iodyl-
CAS Number:
16825-76-6
Molecular Formula:
C6H4ClIO2
Molecular Weight:
270.4522
IUPAC Name:
1-chloro-4-iodylbenzene
InChI:
InChI=1S/C6H4ClIO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H
InChI Key:
NYRLYGAPTPWQDB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)[I](=O)=O
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.894g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.45g/mol
Monoisotopic Mass:
269.894g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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