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20050-91-3 | METHYL-(3-METHYLPHENYL)IODANIUM
CAS No: 20050-91-3 Catalog No: AG007RA9 MDL No:
Product Description
Catalog Number:
AG007RA9
Chemical Name:
METHYL-(3-METHYLPHENYL)IODANIUM
CAS Number:
20050-91-3
Molecular Formula:
C8H10I+
Molecular Weight:
233.0695
IUPAC Name:
methyl-(3-methylphenyl)iodanium
InChI:
InChI=1S/C8H10I/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3/q+1
InChI Key:
RUBFPNKISGEGJG-UHFFFAOYSA-N
SMILES:
C[I+]c1cccc(c1)C
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.983g/mol
Formal Charge:
1
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.072g/mol
Monoisotopic Mass:
232.983g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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