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133350-45-5 | Mercury, (neodecanoato-κO)(2-methoxy-2-phenylethyl)- (9CI)
CAS No: 133350-45-5 Catalog No: AG0014PM MDL No:
Product Description
Catalog Number:
AG0014PM
Chemical Name:
Mercury, (neodecanoato-κO)(2-methoxy-2-phenylethyl)- (9CI)
CAS Number:
133350-45-5
Molecular Formula:
C19H32HgO3
Molecular Weight:
509.0456
IUPAC Name:
7,7-dimethyloctanoic acid;methoxy(2-phenylethyl)mercury
InChI:
InChI=1S/C10H20O2.C8H9.CH3O.Hg/c1-10(2,3)8-6-4-5-7-9(11)12;1-2-8-6-4-3-5-7-8;1-2;/h4-8H2,1-3H3,(H,11,12);3-7H,1-2H2;1H3;/q;;-1;+1
InChI Key:
MBCWZKROORQVQK-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCC(C)(C)C.CO[Hg]CCc1ccccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
510.206g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
509.054g/mol
Monoisotopic Mass:
510.206g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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