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13408-11-2 | Copper, [(4-iodophenyl)ethynyl]-
CAS No: 13408-11-2 Catalog No: AG007MKI MDL No:
Product Description
Catalog Number:
AG007MKI
Chemical Name:
Copper, [(4-iodophenyl)ethynyl]-
CAS Number:
13408-11-2
Molecular Formula:
C8H4CuI
Molecular Weight:
290.5678
IUPAC Name:
copper(1+);1-ethynyl-4-iodobenzene
InChI:
InChI=1S/C8H4I.Cu/c1-2-7-3-5-8(9)6-4-7;/h3-6H;/q-1;+1
InChI Key:
WHQNUBWASOOLNR-UHFFFAOYSA-N
SMILES:
[Cu]C#Cc1ccc(cc1)I
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.865g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.57g/mol
Monoisotopic Mass:
289.865g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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