InChI=1S/C25H28N2O7S2.Na/c1-5-26-20-9-7-17(11-15(20)3)25(18-8-10-21(27-6-2)16(4)12-18)19-13-22(28)24(36(32,33)34)14-23(19)35(29,30)31;/h7-14,26,28H,5-6H2,1-4H3,(H,29,30,31)(H,32,33,34);/q;+1/p-1/b25-18-,27-21+;

【InChIKey】

InChIKey=ACZRDWVARWLTRG-WBVZNFJQSA-M

【SMILES】

CCNc1ccc(cc1C)/C(=C/2\C=C/C(=N\CC)/C(=C2)C)/c3cc(c(cc3S(=O)(=O)O)S(=O)(=O)[O-])O.[Na+]

【MOL File】

XYLENE CYANOL FF.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:3

H bond acceptor:9

XLogP3:2.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

Chem-Impex International, Inc. :XYLENE CYANOL FF

【Safety informationSymbol】

GHS05

GHS07

GHS08

4CML File

XYLENE CYANOL FF.cml

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4463-44-9 XYLENE CYANOL FF

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2Chemical and Physical Properties

【Computed Properties】

3Material Safety Data Sheet(MSDS)

【Safety informationSymbol】

【Signal word】

【Hazard statements】

【Precautionary statements】

4CML File

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XYLENE CYANOL FF