trisodium;8-acetyloxypyrene-1,3,6-trisulfonate


Chemical Name: trisodium;8-acetyloxypyrene-1,3,6-trisulfonate
CAS Number: 115787-83-2
Product Number: AG008SHY(AGN-PC-00OEDM)
Synonyms:
MDL No: MFCD00135685
Molecular Formula: C18H9Na3O11S3
Molecular Weight: 566.42177

Identification/Properties


Computed Properties
Molecular Weight:
566.408g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
2
Exact Mass:
565.9g/mol
Monoisotopic Mass:
565.9g/mol
Topological Polar Surface Area:
223A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
1040
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:
4
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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