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651303-49-0 | Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-
CAS No: 651303-49-0 Catalog No: AG006RRM MDL No:
Product Description
Catalog Number:
AG006RRM
Chemical Name:
Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-
CAS Number:
651303-49-0
Molecular Formula:
C28H25I
Molecular Weight:
488.4026
IUPAC Name:
1-iodo-4-[tris(4-methylphenyl)methyl]benzene
InChI:
InChI=1S/C28H25I/c1-20-4-10-23(11-5-20)28(24-12-6-21(2)7-13-24,25-14-8-22(3)9-15-25)26-16-18-27(29)19-17-26/h4-19H,1-3H3
InChI Key:
RHMKWIZFPMJUTB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(c1ccc(cc1)I)(c1ccc(cc1)C)c1ccc(cc1)C
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
488.1g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
488.412g/mol
Monoisotopic Mass:
488.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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