InChI=1S/C20H19N3O9S3.Ca/c1-10-6-13(9-18(20(10)23)35(30,31)32)19(11-2-4-14(21)16(7-11)33(24,25)26)12-3-5-15(22)17(8-12)34(27,28)29;/h2-9,21H,22-23H2,1H3,(H,24,25,26)(H,27,28,29)(H,30,31,32);/q;+2/p-2/b19-11-,21-14?;

【InChIKey】

InChIKey=SVIISRNRODSEHG-SZRYGYPJSA-L

【SMILES】

[Ca++].CC1=C(N)C(=CC(=C1)C(\C1=CC(=C(N)C=C1)S([O-])(=O)=O)=C1\C=CC(=N)C(=C1)S(O)(=O)=O)S([O-])(=O)=O

【MOL File】

FUCHSIN S, SS, SS, S….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:4

H bond acceptor:12

XLogP3:-4.61

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

Chem-Impex International, Inc. :FUCHSIN S, SS, SS, ST, OR SIII

4CML File

FUCHSIN S, SS, SS, ST, OR SIII.cml

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136132-76-8 FUCHSIN S, SS, SS, ST, OR SIII

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】