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117269-72-4 | Zinc, bromo[(3-cyanophenyl)methyl]-
CAS No: 117269-72-4 Catalog No: AG000E14 MDL No:
Product Description
Catalog Number:
AG000E14
Chemical Name:
Zinc, bromo[(3-cyanophenyl)methyl]-
CAS Number:
117269-72-4
Molecular Formula:
C8H6BrNZn
Molecular Weight:
261.4239
IUPAC Name:
bromozinc(1+);3-methanidylbenzonitrile
InChI:
InChI=1S/C8H6N.BrH.Zn/c1-7-3-2-4-8(5-7)6-9;;/h2-5H,1H2;1H;/q-1;;+2/p-1
InChI Key:
DOAJWWPVOOHMFV-UHFFFAOYSA-M
SMILES:
Br[Zn]Cc1cccc(c1)C#N
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.898g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.427g/mol
Monoisotopic Mass:
258.898g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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