disodium;5-isothiocyanato-2-[2-(4-isothiocyanato-2-sulfonatophenyl)ethyl]benzenesulfonate


Chemical Name: disodium;5-isothiocyanato-2-[2-(4-isothiocyanato-2-sulfonatophenyl)ethyl]benzenesulfonate
CAS Number: 150321-88-3
Product Number: AG001MIS(AGN-PC-0JEKSI)
Synonyms:
MDL No: MFCD00287293
Molecular Formula: C16H10N2Na2O6S4
Molecular Weight: 500.4999

Identification/Properties


Computed Properties
Molecular Weight:
500.484g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
5
Exact Mass:
499.922g/mol
Monoisotopic Mass:
499.922g/mol
Topological Polar Surface Area:
220A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
752
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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