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M1938

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

Synonym(s):

PTS1, Trisodium 8-methoxypyrene-1,3,6-trisulfonate

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About This Item

Empirical Formula (Hill Notation):
C17H9Na3O10S3
CAS Number:
82962-86-5
Molecular Weight:
538.41
PubChem Substance ID:
329817925
MDL number:
MFCD07437980
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mp

253-260 °C (dec.) (lit.)

SMILES string

[Na+].[Na+].[Na+].COc1cc(c2ccc3c(cc(c4ccc1c2c34)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O

InChI

1S/C17H12O10S3.3Na/c1-27-12-6-13(28(18,19)20)9-4-5-11-15(30(24,25)26)7-14(29(21,22)23)10-3-2-8(12)16(9)17(10)11;;;/h2-7H,1H3,(H,18,19,20)(H,21,22,23)(H,24,25,26);;;/q;3*+1/p-3

InChI key

GUGNSJAORJLKGP-UHFFFAOYSA-K

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