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1187165-58-7 | 3-(1,2,3,4-Tetrahydroquinolin-2-ylmethyl)phenylmagnesium bromide 0.25 M in Tetrahydrofuran
CAS No: 1187165-58-7 Catalog No: AG01F333 MDL No:
Product Description
Catalog Number:
AG01F333
Chemical Name:
3-(1,2,3,4-Tetrahydroquinolin-2-ylmethyl)phenylmagnesium bromide 0.25 M in Tetrahydrofuran
CAS Number:
1187165-58-7
Molecular Formula:
C16H16BrMgN
Molecular Weight:
326.5139
IUPAC Name:
magnesium;2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline;bromide
InChI:
InChI=1S/C16H16N.BrH.Mg/c1-2-6-14(7-3-1)12-17-11-10-15-8-4-5-9-16(15)13-17;;/h1-2,4-9H,10-13H2;1H;/q-1;;+2/p-1
InChI Key:
XUHXGTFDNHUMRE-UHFFFAOYSA-M
SMILES:
Br[Mg]c1cccc(c1)CN1CCc2c(C1)cccc2
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.032g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.52g/mol
Monoisotopic Mass:
325.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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