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24356-01-2 | Tetrabenzylzirconium
CAS No: 24356-01-2 Catalog No: AG003857 MDL No:
Product Description
Catalog Number:
AG003857
Chemical Name:
Tetrabenzylzirconium
CAS Number:
24356-01-2
Molecular Formula:
C28H28Zr
Molecular Weight:
455.7459
IUPAC Name:
methanidylbenzene;zirconium(4+)
InChI:
InChI=1S/4C7H7.Zr/c4*1-7-5-3-2-4-6-7;/h4*2-6H,1H2;/q4*-1;+4
InChI Key:
QSLMQGXOMLSFAW-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C[Zr](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
454.124g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
455.756g/mol
Monoisotopic Mass:
454.124g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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