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Structure

8-Dodecanoyloxypyrene-1,3,6-trisulfonic acid trisodium salt

CAS
115787-85-4
Catalog Number
ACM115787854
Category
Other Products
Molecular Weight
706.69
Molecular Formula
C28H29Na3O11S3

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Specification

Synonyms
Trisodium 8-dodecanoyloxypyrene-1,3,6-trisulfonate, 8-Dodecanoyloxypyrene-1,3,6-trisulfonic acid trisodium salt, AGN-PC-000EQ7, 44122_FLUKA, trisodium;8-dodecanoyloxypyrene-1,3,6-trisulfonate, 115787-85-4
IUPAC Name
trisodium;8-dodecanoyloxypyrene-1,3,6-trisulfonate
Canonical SMILES
CCCCCCCCCCCC(=O)OC1=CC(=C2C=CC3=C(C=C(C4=C3C2=C1C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChI Key
NVXUITXLZMPDSZ-UHFFFAOYSA-K
Melting Point
≥250ºC (dec.)(lit.)
Exact Mass
706.05700
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
11
H-Bond Donor
0
Safety Description
26
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