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178233-70-0 | Iodonium, [4-(1-methylethyl)phenyl](4-methylphenyl)-, chloride (1:1)
CAS No: 178233-70-0 Catalog No: AG0025UE MDL No:
Product Description
Catalog Number:
AG0025UE
Chemical Name:
Iodonium, [4-(1-methylethyl)phenyl](4-methylphenyl)-, chloride (1:1)
CAS Number:
178233-70-0
Molecular Formula:
C16H18ClI
Molecular Weight:
372.6716
IUPAC Name:
(4-methylphenyl)-(4-propan-2-ylphenyl)iodanium;chloride
InChI:
InChI=1S/C16H18I.ClH/c1-12(2)14-6-10-16(11-7-14)17-15-8-4-13(3)5-9-15;/h4-12H,1-3H3;1H/q+1;/p-1
InChI Key:
SBNUZKZHHCNPCN-UHFFFAOYSA-M
SMILES:
Cc1ccc(cc1)[I+]c1ccc(cc1)C(C)C.[Cl-]
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.014g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
372.674g/mol
Monoisotopic Mass:
372.014g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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