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116421-85-3 | Magnesium, bromo[4-(1-propyn-1-yl)phenyl]-
CAS No: 116421-85-3 Catalog No: AG000CGN MDL No:
Product Description
Catalog Number:
AG000CGN
Chemical Name:
Magnesium, bromo[4-(1-propyn-1-yl)phenyl]-
CAS Number:
116421-85-3
Molecular Formula:
C9H7BrMg
Molecular Weight:
219.3609
IUPAC Name:
magnesium;prop-1-ynylbenzene;bromide
InChI:
InChI=1S/C9H7.BrH.Mg/c1-2-6-9-7-4-3-5-8-9;;/h4-5,7-8H,1H3;1H;/q-1;;+2/p-1
InChI Key:
UTLSCGXCFGKIPA-UHFFFAOYSA-M
SMILES:
Br[Mg]c1ccc(cc1)C#CC
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.958g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.364g/mol
Monoisotopic Mass:
217.958g/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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