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104130-35-0 | Iodobenzene-13C6
CAS No: 104130-35-0 Catalog No: AG007EN5 MDL No:
Product Description
Catalog Number:
AG007EN5
Chemical Name:
Iodobenzene-13C6
CAS Number:
104130-35-0
Molecular Formula:
C6H5I
Molecular Weight:
209.9643
IUPAC Name:
iodo(1,2,3,4,5,6-13C6)cyclohexatriene
InChI:
InChI=1S/C6H5I/c7-6-4-2-1-3-5-6/h1-5H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key:
SNHMUERNLJLMHN-IDEBNGHGSA-N
SMILES:
I[13c]1[13cH][13cH][13cH][13cH][13cH]1
Properties
Complexity:
46.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.964g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
6
Molecular Weight:
209.965g/mol
Monoisotopic Mass:
209.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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