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144642-72-8 | Mercury, chloro[3-[4-(1-methylethyl)-2-nitrosophenyl]-3-oxopropyl]- (9CI)
CAS No: 144642-72-8 Catalog No: AG001JX2 MDL No:
Product Description
Catalog Number:
AG001JX2
Chemical Name:
Mercury, chloro[3-[4-(1-methylethyl)-2-nitrosophenyl]-3-oxopropyl]- (9CI)
CAS Number:
144642-72-8
Molecular Formula:
C12H14ClHgNO2
Molecular Weight:
440.2881
IUPAC Name:
chloro-[3-(2-nitroso-4-propan-2-ylphenyl)-3-oxopropyl]mercury
InChI:
InChI=1S/C12H14NO2.ClH.Hg/c1-4-12(14)10-6-5-9(8(2)3)7-11(10)13-15;;/h5-8H,1,4H2,2-3H3;1H;/q;;+1/p-1
InChI Key:
OGPQSHAJOGPQIP-UHFFFAOYSA-M
SMILES:
Cl[Hg]CCC(=O)c1ccc(cc1N=O)C(C)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
441.042g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
440.291g/mol
Monoisotopic Mass:
441.042g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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