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132283-74-0 | 3,4-Dimethoxyphenethylmagnesium bromide, 0.5M 2-MeTHF
CAS No: 132283-74-0 Catalog No: AG01F88B MDL No:
Product Description
Catalog Number:
AG01F88B
Chemical Name:
3,4-Dimethoxyphenethylmagnesium bromide, 0.5M 2-MeTHF
CAS Number:
132283-74-0
Molecular Formula:
C10H13BrMgO2
Molecular Weight:
269.4180
IUPAC Name:
magnesium;4-ethyl-1,2-dimethoxybenzene;bromide
InChI:
InChI=1S/C10H13O2.BrH.Mg/c1-4-8-5-6-9(11-2)10(7-8)12-3;;/h5-7H,1,4H2,2-3H3;1H;/q-1;;+2/p-1
InChI Key:
RIIBHXAAPKMWOR-UHFFFAOYSA-M
SMILES:
COc1cc(ccc1OC)CC[Mg+].[Br-]
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.995g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.421g/mol
Monoisotopic Mass:
267.995g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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