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35258-28-7 | 4-(2-N,N-Pyrrolidinoethoxy)phenylmagnesium bromide, 0.25M THF
CAS No: 35258-28-7 Catalog No: AG01F6K2 MDL No:
Product Description
Catalog Number:
AG01F6K2
Chemical Name:
4-(2-N,N-Pyrrolidinoethoxy)phenylmagnesium bromide, 0.25M THF
CAS Number:
35258-28-7
Molecular Formula:
C12H16BrMgNO
Molecular Weight:
294.4705
IUPAC Name:
magnesium;1-[2-(phenoxy)ethyl]pyrrolidine;bromide
InChI:
InChI=1S/C12H16NO.BrH.Mg/c1-2-6-12(7-3-1)14-11-10-13-8-4-5-9-13;;/h2-3,6-7H,4-5,8-11H2;1H;/q-1;;+2/p-1
InChI Key:
IBJMTKOUTUSDKW-UHFFFAOYSA-M
SMILES:
[Mg+]c1ccc(cc1)OCCN1CCCC1.[Br-]
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.027g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.475g/mol
Monoisotopic Mass:
293.027g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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