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87579-63-3 | Mercury, [(4-fluorophenyl)ethynyl]phenyl-
CAS No: 87579-63-3 Catalog No: AG004MC1 MDL No:
Product Description
Catalog Number:
AG004MC1
Chemical Name:
Mercury, [(4-fluorophenyl)ethynyl]phenyl-
CAS Number:
87579-63-3
Molecular Formula:
C14H9FHg
Molecular Weight:
396.8097
IUPAC Name:
2-(4-fluorophenyl)ethynyl-phenylmercury
InChI:
InChI=1S/C8H4F.C6H5.Hg/c1-2-7-3-5-8(9)6-4-7;1-2-4-6-5-3-1;/h3-6H;1-5H;
InChI Key:
DSDNXOAQTZEIHB-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C#C[Hg]c1ccccc1
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.039g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.816g/mol
Monoisotopic Mass:
398.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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