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6385-58-6 | 2,2-THIOBIS(4,6-DICHLOROPHENOL) DISODIUM SALT
CAS No: 6385-58-6 Catalog No: AG003FCN MDL No:MFCD00058975
Product Description
Catalog Number:
AG003FCN
Chemical Name:
2,2-THIOBIS(4,6-DICHLOROPHENOL) DISODIUM SALT
CAS Number:
6385-58-6
MDL Number:
MFCD00058975
IUPAC Name:
disodium;2,4-dichloro-6-(3,5-dichloro-2-oxidophenyl)sulfanylphenolate
InChI:
InChI=1S/C12H6Cl4O2S.2Na/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18;;/h1-4,17-18H;;/q;2*+1/p-2
InChI Key:
FNYZFZRGBBCWBI-UHFFFAOYSA-L
UNII:
66V0139H9A
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.845g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
400.002g/mol
Monoisotopic Mass:
397.848g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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