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67478-46-0 | 2-Iodo-1-trityl-1H-imidazole
CAS No: 67478-46-0 Catalog No: AG006G8V MDL No:MFCD02179529
Product Description
Catalog Number:
AG006G8V
Chemical Name:
2-Iodo-1-trityl-1H-imidazole
CAS Number:
67478-46-0
Molecular Formula:
C22H17IN2
Molecular Weight:
436.2883
MDL Number:
MFCD02179529
IUPAC Name:
2-iodo-1-tritylimidazole
InChI:
InChI=1S/C22H17IN2/c23-21-24-16-17-25(21)22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H
InChI Key:
AAHIYUWXFHXGBO-UHFFFAOYSA-N
SMILES:
Ic1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
436.044g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
436.296g/mol
Monoisotopic Mass:
436.044g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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